Compounds > 1,3,5-trimethoxybenzene
Page last updated: 2024-09-23

1,3,5-trimethoxybenzene

Description

1,3,5-trimethoxybenzene : A methoxybenzene carrying methoxy groups at positions 1, 3 and 5. It has been found to be a biomarker of flavonoid consumption in humans. [Chemical Entities of Biological Interest (ChEBI), Hastings J, Owen G, Dekker A, Ennis M, Kale N, Muthukrishnan V, Turner S, Swainston N, Mendes P, Steinbeck C. (2016). ChEBI in 2016: Improved services and an expanding collection of metabolites. Nucleic Acids Res]

Cross-References

ID SourceID
PubMed CID69301
CHEMBL ID1605492
CHEBI ID31038
SCHEMBL ID28493
MeSH IDM0064920

Synonyms (81)

Synonym
nsc90060
621-23-8
1,5-trimethoxybenzene
1,5-trimethyoxybenzene
nsc-90060
HMS1763E15
CHEBI:31038 ,
BRD-K81884069-001-02-8
phloroglucinol trimethyl ether
benzene, 1,3,5-trimethoxy-
NCIOPEN2_001419
SPECTRUM_001404
1,3,5-trimethoxybenzene
1,3,5-trimethyoxybenzene
einecs 210-673-4
brn 1307993
sym-trimethoxybenzene
o,o,o-1,3,5-trimethylresorcinol
nsc 90060
BSPBIO_002819
SPECTRUM5_001766
1,3,5-trimethoxybenzene (jan)
D01792
1,3,5-trimethoxybenzene, reagentplus(r), >=99%
NCGC00095239-01
NCGC00095239-02
KBIO2_007020
KBIOGR_001765
KBIO2_001884
KBIO2_004452
KBIO3_002039
KBIOSS_001884
SPECTRUM3_001030
SPBIO_000412
SPECTRUM4_001163
SPECTRUM2_000426
SPECTRUM231043
NCGC00095239-03
inchi=1/c9h12o3/c1-10-7-4-8(11-2)6-9(5-7)12-3/h4-6h,1-3h
MLS002207155
smr001306732
P0250
HMS1923E11
AKOS000120577
A833592
00vji3vg3d ,
4-06-00-07362 (beilstein handbook reference)
unii-00vji3vg3d
dtxsid0045963 ,
tox21_111489
cas-621-23-8
dtxcid8025963
CCG-39953
FT-0606514
S6294
1,3,5-trimethoxy benzene
CHEMBL1605492
phloroglucinol trimethyl ether [inci]
trimethylphloroglucinol [who-dd]
1,3,5-trimethoxybenzene [jan]
1,3,5-trimethoxy-benzene
2,4,6-trimethoxy-benzene
1,3,5 -trimethoxybenzene
SCHEMBL28493
tox21_111489_1
NCGC00095239-05
Q-200071
mfcd00008385
CS-W009141
1,3,5-trimethoxybenzene, standard for quantitative nmr, tracecert(r)
D70893
1,3,5-trimethoxybenzene, vetec(tm) reagent grade, 98%
SY018307
1,3,5-trimethoxybenzol
HY-Y0678
Q27114090
AS-10870
AM10837
BRD-K81884069-001-03-6
EN300-16208
Z54718053

Roles (2)

RoleDescription
biomarkerA substance used as an indicator of a biological state.
human xenobiotic metaboliteAny human metabolite produced by metabolism of a xenobiotic compound in humans.
[role information is derived from Chemical Entities of Biological Interest (ChEBI), Hastings J, Owen G, Dekker A, Ennis M, Kale N, Muthukrishnan V, Turner S, Swainston N, Mendes P, Steinbeck C. (2016). ChEBI in 2016: Improved services and an expanding collection of metabolites. Nucleic Acids Res]

Drug Classes (1)

ClassDescription
methoxybenzenesAny aromatic ether that consists of a benzene skeleton substituted with one or more methoxy groups.
[compound class information is derived from Chemical Entities of Biological Interest (ChEBI), Hastings J, Owen G, Dekker A, Ennis M, Kale N, Muthukrishnan V, Turner S, Swainston N, Mendes P, Steinbeck C. (2016). ChEBI in 2016: Improved services and an expanding collection of metabolites. Nucleic Acids Res]

Pathways (1)

1,3,5-trimethoxybenzene is involved in 1 pathway(s), involving a total of 11 unique proteins and 14 unique compounds

PathwayProteinsCompounds
1,3,5-trimethoxybenzene biosynthesis57
1,3,5-trimethoxybenzene biosynthesis67

Protein Targets (4)

Potency Measurements

ProteinTaxonomyMeasurementAverage (µ)Min (ref.)Avg (ref.)Max (ref.)Bioassay(s)
aldehyde dehydrogenase 1 family, member A1Homo sapiens (human)Potency1.88700.011212.4002100.0000AID1030
peroxisome proliferator-activated receptor deltaHomo sapiens (human)Potency13.33220.001024.504861.6448AID743212
nuclear receptor ROR-gamma isoform 1Mus musculus (house mouse)Potency31.62280.00798.23321,122.0200AID2551
gemininHomo sapiens (human)Potency13.33590.004611.374133.4983AID624297
[prepared from compound, protein, and bioassay information from National Library of Medicine (NLM), extracted Dec-2023]

Bioassays (49)

Assay IDTitleYearJournalArticle
AID1296008Cytotoxic Profiling of Annotated Libraries Using Quantitative High-Throughput Screening2020SLAS discovery : advancing life sciences R & D, 01, Volume: 25, Issue:1
Cytotoxic Profiling of Annotated and Diverse Chemical Libraries Using Quantitative High-Throughput Screening.
AID1346987P-glycoprotein substrates identified in KB-8-5-11 adenocarcinoma cell line, qHTS therapeutic library screen2019Molecular pharmacology, 11, Volume: 96, Issue:5
A High-Throughput Screen of a Library of Therapeutics Identifies Cytotoxic Substrates of P-glycoprotein.
AID1346986P-glycoprotein substrates identified in KB-3-1 adenocarcinoma cell line, qHTS therapeutic library screen2019Molecular pharmacology, 11, Volume: 96, Issue:5
A High-Throughput Screen of a Library of Therapeutics Identifies Cytotoxic Substrates of P-glycoprotein.
AID1347101qHTS of pediatric cancer cell lines to identify multiple opportunities for drug repurposing: Primary screen for BT-12 cells2018Oncotarget, Jan-12, Volume: 9, Issue:4
Quantitative high-throughput phenotypic screening of pediatric cancer cell lines identifies multiple opportunities for drug repurposing.
AID1745845Primary qHTS for Inhibitors of ATXN expression
AID1347108qHTS of pediatric cancer cell lines to identify multiple opportunities for drug repurposing: Primary screen for Rh41 cells2018Oncotarget, Jan-12, Volume: 9, Issue:4
Quantitative high-throughput phenotypic screening of pediatric cancer cell lines identifies multiple opportunities for drug repurposing.
AID1347092qHTS of pediatric cancer cell lines to identify multiple opportunities for drug repurposing: Primary screen for A673 cells2018Oncotarget, Jan-12, Volume: 9, Issue:4
Quantitative high-throughput phenotypic screening of pediatric cancer cell lines identifies multiple opportunities for drug repurposing.
AID1347089qHTS of pediatric cancer cell lines to identify multiple opportunities for drug repurposing: Primary screen for TC32 cells2018Oncotarget, Jan-12, Volume: 9, Issue:4
Quantitative high-throughput phenotypic screening of pediatric cancer cell lines identifies multiple opportunities for drug repurposing.
AID1347098qHTS of pediatric cancer cell lines to identify multiple opportunities for drug repurposing: Primary screen for SK-N-SH cells2018Oncotarget, Jan-12, Volume: 9, Issue:4
Quantitative high-throughput phenotypic screening of pediatric cancer cell lines identifies multiple opportunities for drug repurposing.
AID1347424RapidFire Mass Spectrometry qHTS Assay for Modulators of WT P53-Induced Phosphatase 1 (WIP1)2019The Journal of biological chemistry, 11-15, Volume: 294, Issue:46
Physiologically relevant orthogonal assays for the discovery of small-molecule modulators of WIP1 phosphatase in high-throughput screens.
AID1347104qHTS of pediatric cancer cell lines to identify multiple opportunities for drug repurposing: Primary screen for RD cells2018Oncotarget, Jan-12, Volume: 9, Issue:4
Quantitative high-throughput phenotypic screening of pediatric cancer cell lines identifies multiple opportunities for drug repurposing.
AID1347106qHTS of pediatric cancer cell lines to identify multiple opportunities for drug repurposing: Primary screen for control Hh wild type fibroblast cells2018Oncotarget, Jan-12, Volume: 9, Issue:4
Quantitative high-throughput phenotypic screening of pediatric cancer cell lines identifies multiple opportunities for drug repurposing.
AID1347407qHTS to identify inhibitors of the type 1 interferon - major histocompatibility complex class I in skeletal muscle: primary screen against the NCATS Pharmaceutical Collection2020ACS chemical biology, 07-17, Volume: 15, Issue:7
High-Throughput Screening to Identify Inhibitors of the Type I Interferon-Major Histocompatibility Complex Class I Pathway in Skeletal Muscle.
AID1347107qHTS of pediatric cancer cell lines to identify multiple opportunities for drug repurposing: Primary screen for Rh30 cells2018Oncotarget, Jan-12, Volume: 9, Issue:4
Quantitative high-throughput phenotypic screening of pediatric cancer cell lines identifies multiple opportunities for drug repurposing.
AID1347094qHTS of pediatric cancer cell lines to identify multiple opportunities for drug repurposing: Primary screen for BT-37 cells2018Oncotarget, Jan-12, Volume: 9, Issue:4
Quantitative high-throughput phenotypic screening of pediatric cancer cell lines identifies multiple opportunities for drug repurposing.
AID1347086qHTS for Inhibitors of the Functional Ribonucleoprotein Complex (vRNP) of Lymphocytic Choriomeningitis Arenaviruses (LCMV): LCMV Primary Screen - GLuc reporter signal2020Antiviral research, 01, Volume: 173A cell-based, infectious-free, platform to identify inhibitors of lassa virus ribonucleoprotein (vRNP) activity.
AID1508630Primary qHTS for small molecule stabilizers of the endoplasmic reticulum resident proteome: Secreted ER Calcium Modulated Protein (SERCaMP) assay2021Cell reports, 04-27, Volume: 35, Issue:4
A target-agnostic screen identifies approved drugs to stabilize the endoplasmic reticulum-resident proteome.
AID1347082qHTS for Inhibitors of the Functional Ribonucleoprotein Complex (vRNP) of Lassa (LASV) Arenavirus: LASV Primary Screen - GLuc reporter signal2020Antiviral research, 01, Volume: 173A cell-based, infectious-free, platform to identify inhibitors of lassa virus ribonucleoprotein (vRNP) activity.
AID1347097qHTS of pediatric cancer cell lines to identify multiple opportunities for drug repurposing: Primary screen for Saos-2 cells2018Oncotarget, Jan-12, Volume: 9, Issue:4
Quantitative high-throughput phenotypic screening of pediatric cancer cell lines identifies multiple opportunities for drug repurposing.
AID1347090qHTS of pediatric cancer cell lines to identify multiple opportunities for drug repurposing: Primary screen for DAOY cells2018Oncotarget, Jan-12, Volume: 9, Issue:4
Quantitative high-throughput phenotypic screening of pediatric cancer cell lines identifies multiple opportunities for drug repurposing.
AID1347091qHTS of pediatric cancer cell lines to identify multiple opportunities for drug repurposing: Primary screen for SJ-GBM2 cells2018Oncotarget, Jan-12, Volume: 9, Issue:4
Quantitative high-throughput phenotypic screening of pediatric cancer cell lines identifies multiple opportunities for drug repurposing.
AID1347102qHTS of pediatric cancer cell lines to identify multiple opportunities for drug repurposing: Primary screen for Rh18 cells2018Oncotarget, Jan-12, Volume: 9, Issue:4
Quantitative high-throughput phenotypic screening of pediatric cancer cell lines identifies multiple opportunities for drug repurposing.
AID1347093qHTS of pediatric cancer cell lines to identify multiple opportunities for drug repurposing: Primary screen for SK-N-MC cells2018Oncotarget, Jan-12, Volume: 9, Issue:4
Quantitative high-throughput phenotypic screening of pediatric cancer cell lines identifies multiple opportunities for drug repurposing.
AID1347100qHTS of pediatric cancer cell lines to identify multiple opportunities for drug repurposing: Primary screen for LAN-5 cells2018Oncotarget, Jan-12, Volume: 9, Issue:4
Quantitative high-throughput phenotypic screening of pediatric cancer cell lines identifies multiple opportunities for drug repurposing.
AID1347083qHTS for Inhibitors of the Functional Ribonucleoprotein Complex (vRNP) of Lassa (LASV) Arenavirus: Viability assay - alamar blue signal for LASV Primary Screen2020Antiviral research, 01, Volume: 173A cell-based, infectious-free, platform to identify inhibitors of lassa virus ribonucleoprotein (vRNP) activity.
AID1347154Primary screen GU AMC qHTS for Zika virus inhibitors2020Proceedings of the National Academy of Sciences of the United States of America, 12-08, Volume: 117, Issue:49
Therapeutic candidates for the Zika virus identified by a high-throughput screen for Zika protease inhibitors.
AID1347105qHTS of pediatric cancer cell lines to identify multiple opportunities for drug repurposing: Primary screen for MG 63 (6-TG R) cells2018Oncotarget, Jan-12, Volume: 9, Issue:4
Quantitative high-throughput phenotypic screening of pediatric cancer cell lines identifies multiple opportunities for drug repurposing.
AID1347103qHTS of pediatric cancer cell lines to identify multiple opportunities for drug repurposing: Primary screen for OHS-50 cells2018Oncotarget, Jan-12, Volume: 9, Issue:4
Quantitative high-throughput phenotypic screening of pediatric cancer cell lines identifies multiple opportunities for drug repurposing.
AID651635Viability Counterscreen for Primary qHTS for Inhibitors of ATXN expression
AID1347095qHTS of pediatric cancer cell lines to identify multiple opportunities for drug repurposing: Primary screen for NB-EBc1 cells2018Oncotarget, Jan-12, Volume: 9, Issue:4
Quantitative high-throughput phenotypic screening of pediatric cancer cell lines identifies multiple opportunities for drug repurposing.
AID1347096qHTS of pediatric cancer cell lines to identify multiple opportunities for drug repurposing: Primary screen for U-2 OS cells2018Oncotarget, Jan-12, Volume: 9, Issue:4
Quantitative high-throughput phenotypic screening of pediatric cancer cell lines identifies multiple opportunities for drug repurposing.
AID1347099qHTS of pediatric cancer cell lines to identify multiple opportunities for drug repurposing: Primary screen for NB1643 cells2018Oncotarget, Jan-12, Volume: 9, Issue:4
Quantitative high-throughput phenotypic screening of pediatric cancer cell lines identifies multiple opportunities for drug repurposing.
AID1347425Rhodamine-PBP qHTS Assay for Modulators of WT P53-Induced Phosphatase 1 (WIP1)2019The Journal of biological chemistry, 11-15, Volume: 294, Issue:46
Physiologically relevant orthogonal assays for the discovery of small-molecule modulators of WIP1 phosphatase in high-throughput screens.
AID588501High-throughput multiplex microsphere screening for inhibitors of toxin protease, specifically Lethal Factor Protease, MLPCN compound set2010Current protocols in cytometry, Oct, Volume: Chapter 13Microsphere-based flow cytometry protease assays for use in protease activity detection and high-throughput screening.
AID588501High-throughput multiplex microsphere screening for inhibitors of toxin protease, specifically Lethal Factor Protease, MLPCN compound set2006Cytometry. Part A : the journal of the International Society for Analytical Cytology, May, Volume: 69, Issue:5
Microsphere-based protease assays and screening application for lethal factor and factor Xa.
AID588501High-throughput multiplex microsphere screening for inhibitors of toxin protease, specifically Lethal Factor Protease, MLPCN compound set2010Assay and drug development technologies, Feb, Volume: 8, Issue:1
High-throughput multiplex flow cytometry screening for botulinum neurotoxin type a light chain protease inhibitors.
AID588499High-throughput multiplex microsphere screening for inhibitors of toxin protease, specifically Botulinum neurotoxin light chain A protease, MLPCN compound set2010Current protocols in cytometry, Oct, Volume: Chapter 13Microsphere-based flow cytometry protease assays for use in protease activity detection and high-throughput screening.
AID588499High-throughput multiplex microsphere screening for inhibitors of toxin protease, specifically Botulinum neurotoxin light chain A protease, MLPCN compound set2006Cytometry. Part A : the journal of the International Society for Analytical Cytology, May, Volume: 69, Issue:5
Microsphere-based protease assays and screening application for lethal factor and factor Xa.
AID588499High-throughput multiplex microsphere screening for inhibitors of toxin protease, specifically Botulinum neurotoxin light chain A protease, MLPCN compound set2010Assay and drug development technologies, Feb, Volume: 8, Issue:1
High-throughput multiplex flow cytometry screening for botulinum neurotoxin type a light chain protease inhibitors.
AID588497High-throughput multiplex microsphere screening for inhibitors of toxin protease, specifically Botulinum neurotoxin light chain F protease, MLPCN compound set2010Current protocols in cytometry, Oct, Volume: Chapter 13Microsphere-based flow cytometry protease assays for use in protease activity detection and high-throughput screening.
AID588497High-throughput multiplex microsphere screening for inhibitors of toxin protease, specifically Botulinum neurotoxin light chain F protease, MLPCN compound set2006Cytometry. Part A : the journal of the International Society for Analytical Cytology, May, Volume: 69, Issue:5
Microsphere-based protease assays and screening application for lethal factor and factor Xa.
AID588497High-throughput multiplex microsphere screening for inhibitors of toxin protease, specifically Botulinum neurotoxin light chain F protease, MLPCN compound set2010Assay and drug development technologies, Feb, Volume: 8, Issue:1
High-throughput multiplex flow cytometry screening for botulinum neurotoxin type a light chain protease inhibitors.
AID504749qHTS profiling for inhibitors of Plasmodium falciparum proliferation2011Science (New York, N.Y.), Aug-05, Volume: 333, Issue:6043
Chemical genomic profiling for antimalarial therapies, response signatures, and molecular targets.
AID540299A screen for compounds that inhibit the MenB enzyme of Mycobacterium tuberculosis2010Bioorganic & medicinal chemistry letters, Nov-01, Volume: 20, Issue:21
Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis.
AID588519A screen for compounds that inhibit viral RNA polymerase binding and polymerization activities2011Antiviral research, Sep, Volume: 91, Issue:3
High-throughput screening identification of poliovirus RNA-dependent RNA polymerase inhibitors.
AID977599Inhibition of sodium fluorescein uptake in OATP1B1-transfected CHO cells at an equimolar substrate-inhibitor concentration of 10 uM2013Molecular pharmacology, Jun, Volume: 83, Issue:6
Structure-based identification of OATP1B1/3 inhibitors.
AID977602Inhibition of sodium fluorescein uptake in OATP1B3-transfected CHO cells at an equimolar substrate-inhibitor concentration of 10 uM2013Molecular pharmacology, Jun, Volume: 83, Issue:6
Structure-based identification of OATP1B1/3 inhibitors.
AID1159607Screen for inhibitors of RMI FANCM (MM2) intereaction2016Journal of biomolecular screening, Jul, Volume: 21, Issue:6
A High-Throughput Screening Strategy to Identify Protein-Protein Interaction Inhibitors That Block the Fanconi Anemia DNA Repair Pathway.
AID1159550Human Phosphogluconate dehydrogenase (6PGD) Inhibitor Screening2015Nature cell biology, Nov, Volume: 17, Issue:11
6-Phosphogluconate dehydrogenase links oxidative PPP, lipogenesis and tumour growth by inhibiting LKB1-AMPK signalling.
[information is prepared from bioassay data collected from National Library of Medicine (NLM), extracted Dec-2023]

Research

Studies (36)

TimeframeStudies, This Drug (%)All Drugs %
pre-19903 (8.33)18.7374
1990's0 (0.00)18.2507
2000's10 (27.78)29.6817
2010's16 (44.44)24.3611
2020's7 (19.44)2.80
[information is prepared from research data collected from National Library of Medicine (NLM), extracted Dec-2023]

Study Types

Publication TypeThis drug (%)All Drugs (%)
Trials1 (2.70%)5.53%
Reviews3 (8.11%)6.00%
Case Studies0 (0.00%)4.05%
Observational0 (0.00%)0.25%
Other33 (89.19%)84.16%
[information is prepared from research data collected from National Library of Medicine (NLM), extracted Dec-2023]
SubstanceDescriptionRelationhip StrengthStudiesTrialsClassesRoles
phloroglucinol[no description available]medium191benzenetriol;
phenolic donor		algal metabolite
glycine[no description available]medium10alpha-amino acid;
amino acid zwitterion;
proteinogenic amino acid;
serine family amino acid		EC 2.1.2.1 (glycine hydroxymethyltransferase) inhibitor;
fundamental metabolite;
hepatoprotective agent;
micronutrient;
neurotransmitter;
NMDA receptor agonist;
nutraceutical
iodine monochloride[no description available]medium10
iodine[no description available]medium10diatomic iodinenutrient
iodine[no description available]medium10halide anion;
monoatomic iodine		human metabolite
chlorine[no description available]medium20halide anion;
monoatomic chlorine		cofactor;
Escherichia coli metabolite;
human metabolite
bromide[no description available]medium20halide anion;
monoatomic bromine
iodobromine[no description available]medium10
1,4-dimethoxybenzene[no description available]medium10dimethoxybenzene
veratrole[no description available]medium10dimethoxybenzeneplant metabolite
lignin[no description available]medium10
ozone[no description available]medium10elemental molecule;
gas molecular entity;
reactive oxygen species;
triatomic oxygen		antiseptic drug;
disinfectant;
electrophilic reagent;
greenhouse gas;
mutagen;
oxidising agent;
tracer
anisole[no description available]medium20monomethoxybenzeneplant metabolite
1,3-dimethoxybenzene[no description available]medium20methoxybenzenes
dibenzofuran[no description available]medium10dibenzofurans;
mancude organic heterotricyclic parent;
polycyclic heteroarene		xenobiotic
dibenzo-18-crown-6[no description available]medium10benzenes;
crown ether		phase-transfer catalyst
benzofurans[no description available]medium10
dichlorocarbene[no description available]medium10carbene
1,4-thioxane[no description available]medium20
glycosides[no description available]medium20
lubiprostone[no description available]medium10
alprostadil[no description available]medium10prostaglandins Eanticoagulant;
human metabolite;
platelet aggregation inhibitor;
vasodilator agent
phenylalanine[no description available]medium10amino acid zwitterion;
erythrose 4-phosphate/phosphoenolpyruvate family amino acid;
L-alpha-amino acid;
phenylalanine;
proteinogenic amino acid		algal metabolite;
EC 3.1.3.1 (alkaline phosphatase) inhibitor;
Escherichia coli metabolite;
human xenobiotic metabolite;
micronutrient;
mouse metabolite;
nutraceutical;
plant metabolite;
Saccharomyces cerevisiae metabolite
alosetron[no description available]medium10imidazoles;
pyridoindole		antiemetic;
gastrointestinal drug;
serotonergic antagonist
tegaserod[no description available]medium10carboxamidine;
guanidines;
hydrazines;
indoles		gastrointestinal drug;
serotonergic agonist
renzapride[no description available]medium10
rifamycins[no description available]medium10
3,5-dimethoxytoluene[no description available]medium10methoxybenzenes;
toluenes		fragrance;
plant metabolite
orcinol[no description available]medium105-alkylresorcinol;
dihydroxytoluene		Aspergillus metabolite
2-dichlorobenzene[no description available]medium10dichlorobenzenehepatotoxic agent;
metabolite
sorbic acid[no description available]medium10alpha,beta-unsaturated monocarboxylic acid;
sorbic acid
2-cresol[no description available]medium10cresolhuman xenobiotic metabolite
platinum[no description available]medium10elemental platinum;
nickel group element atom;
platinum group metal atom
hydrogen[no description available]medium10elemental hydrogen;
elemental molecule;
gas molecular entity		antioxidant;
electron donor;
food packaging gas;
fuel;
human metabolite
mocetinostat[no description available]medium10aminopyrimidine;
benzamides;
pyridines;
secondary amino compound;
secondary carboxamide;
substituted aniline		antineoplastic agent;
apoptosis inducer;
autophagy inducer;
cardioprotective agent;
EC 3.5.1.98 (histone deacetylase) inhibitor;
hepatotoxic agent
butyraldehyde[no description available]low00butanalsbiomarker;
Escherichia coli metabolite;
mouse metabolite
carbon monoxide[no description available]low00carbon oxide;
gas molecular entity;
one-carbon compound		biomarker;
EC 1.9.3.1 (cytochrome c oxidase) inhibitor;
human metabolite;
ligand;
metabolite;
mitochondrial respiratory-chain inhibitor;
mouse metabolite;
neurotoxin;
neurotransmitter;
P450 inhibitor;
probe;
signalling molecule;
vasodilator agent
3-methoxytyramine[no description available]low00monomethoxybenzene;
phenols;
phenylethylamine;
primary amino compound		biomarker;
human blood serum metabolite;
human urinary metabolite
arginine[no description available]low00arginine;
glutamine family amino acid;
L-alpha-amino acid;
proteinogenic amino acid		biomarker;
Escherichia coli metabolite;
micronutrient;
mouse metabolite;
nutraceutical
heptanal[no description available]low00medium-chain fatty aldehyde;
n-alkanal;
saturated fatty aldehyde		biomarker
homoarginine[no description available]low00homoarginine;
L-lysine derivative;
non-proteinogenic L-alpha-amino acid		biomarker;
EC 3.1.3.1 (alkaline phosphatase) inhibitor;
human metabolite;
rat metabolite;
xenobiotic metabolite
malondialdehyde[no description available]low00dialdehydebiomarker
phenylglyoxylic acid[no description available]low002-oxo monocarboxylic acidbiomarker;
human xenobiotic metabolite
isodesmosine[no description available]low00lysine derivative;
pyridinium ion		biomarker
pristane[no description available]low00long-chain alkane;
norterpene		biomarker;
immunological adjuvant
4-heptanone[no description available]low00dialkyl ketonebiomarker;
human urinary metabolite;
human xenobiotic metabolite;
rat metabolite
rubidium chloride[no description available]low00inorganic chloride;
rubidium molecular entity		antidepressant;
biomarker
n-acetyltyrosine[no description available]low00N-acetyltyrosine;
N-acyl-L-tyrosine		biomarker;
EC 2.1.1.4 (acetylserotonin O-methyltransferase) inhibitor;
human urinary metabolite
nicotine[no description available]low003-(1-methylpyrrolidin-2-yl)pyridineanxiolytic drug;
biomarker;
immunomodulator;
mitogen;
neurotoxin;
nicotinic acetylcholine receptor agonist;
peripheral nervous system drug;
phytogenic insecticide;
plant metabolite;
psychotropic drug;
teratogenic agent;
xenobiotic
5,6-dihydrouridine[no description available]low00uridinesbiomarker
delta(9)-tetrahydrocannabinolic acid[no description available]low00benzochromene;
diterpenoid;
hydroxy monocarboxylic acid;
phytocannabinoid;
polyketide		anti-inflammatory agent;
biomarker;
metabolite;
neuroprotective agent
4-(methylnitrosamino)-1-(3-pyridyl)-1-butan-1-ol[no description available]low00nitrosamine;
pyridines;
secondary alcohol		biomarker;
carcinogenic agent;
human urinary metabolite
dityrosine[no description available]low00biphenyls;
non-proteinogenic alpha-amino acid;
tyrosine derivative		biomarker
3-chloro-L-tyrosine[no description available]low00chloroamino acid;
L-alpha-amino acid zwitterion;
L-tyrosine derivative;
monochlorobenzenes;
non-proteinogenic L-alpha-amino acid		biomarker;
human metabolite
pentosidine[no description available]low00imidazopyridine;
non-proteinogenic L-alpha-amino acid		biomarker;
cross-linking reagent
24-hydroxycholesterol[no description available]low0024-hydroxycholesterolbiomarker;
human blood serum metabolite;
mouse metabolite
hawkinsin[no description available]low00cycloalkene;
cysteine derivative;
dicarboxylic acid;
diol;
secondary allylic alcohol;
tertiary allylic alcohol		biomarker;
human urinary metabolite
3-octanone[no description available]low00dialkyl ketoneantifeedant;
biomarker;
fungal metabolite;
human urinary metabolite;
insect attractant;
plant metabolite;
toxin
isoferulic acid[no description available]low00ferulic acidsantioxidant;
biomarker;
metabolite
cotinine[no description available]low00N-alkylpyrrolidine;
pyridines;
pyrrolidin-2-ones;
pyrrolidine alkaloid		antidepressant;
biomarker;
human xenobiotic metabolite;
plant metabolite
s-phenyl-n-acetylcysteine[no description available]low00aryl sulfide;
S-substituted N-acetyl-L-cysteine		biomarker;
human urinary metabolite
1,6-anhydro-beta-glucopyranose[no description available]low00anhydrohexoseArabidopsis thaliana metabolite;
biomarker;
human metabolite
cryptoxanthins[no description available]low00carotenolantioxidant;
biomarker;
plant metabolite;
provitamin A
brassicasterol[no description available]low003beta-hydroxy-Delta(5)-steroid;
3beta-sterol;
ergostanoid;
phytosterols		algal metabolite;
animal metabolite;
biomarker;
EC 1.3.1.72 (Delta(24)-sterol reductase) inhibitor;
human metabolite;
marine metabolite;
plant metabolite;
sterol biosynthesis inhibitor
8-epi-prostaglandin f2alpha[no description available]low00F2-isoprostanebiomarker;
bronchoconstrictor agent;
vasoconstrictor agent
ubiquinone 8[no description available]low00ubiquinonesbiomarker
muconic acid[no description available]low00muconic acidbiomarker;
human xenobiotic metabolite
dehydroergosterol[no description available]low003beta-hydroxy-Delta(5)-steroid;
3beta-sterol;
ergostanoid;
phytosterols		biomarker;
metabolite
ophthalmic acid[no description available]low00L-glutamine derivativebiomarker;
human metabolite
ubiquinol[no description available]low00polyprenylhydroquinone;
ubiquinol		biomarker;
metabolite
3-[1-(2,6-dichloro-3-fluorophenyl)ethoxy]-5-[1-(piperidin-4-yl)pyrazol-4-yl]pyridin-2-amine[no description available]low00aminopyridine;
aromatic ether;
dichlorobenzene;
organofluorine compound;
pyrazolylpiperidine;
racemate		antineoplastic agent;
biomarker;
EC 2.7.10.1 (receptor protein-tyrosine kinase) inhibitor
crizotinib[no description available]low003-[1-(2,6-dichloro-3-fluorophenyl)ethoxy]-5-[1-(piperidin-4-yl)pyrazol-4-yl]pyridin-2-amineantineoplastic agent;
biomarker;
EC 2.7.10.1 (receptor protein-tyrosine kinase) inhibitor
apelin-13 peptide[no description available]low00oligopeptideantihypertensive agent;
autophagy inhibitor;
biomarker;
human metabolite;
neuroprotective agent
guanosine monophosphate[no description available]low00guanosine 5'-phosphate;
purine ribonucleoside 5'-monophosphate		biomarker;
Escherichia coli metabolite;
metabolite;
mouse metabolite
8-hydroxy-2'-deoxyguanosine[no description available]low00guanosinesbiomarker
8-nitroguanosine 3',5'-cyclic monophosphate[no description available]low003',5'-cyclic purine nucleotide;
C-nitro compound		biomarker;
Brassica napus metabolite;
human metabolite;
signalling molecule
apelin-12 peptide[no description available]low00oligopeptidebiomarker;
human blood serum metabolite;
human metabolite;
neuroprotective agent
2,3-dihydroxybenzoic acid[no description available]low00dihydroxybenzoic acidhuman xenobiotic metabolite;
plant metabolite
2,5-dichlorophenol[no description available]low00dichlorophenolhuman xenobiotic metabolite
protocatechuic acid[no description available]low00catechols;
dihydroxybenzoic acid		antineoplastic agent;
EC 1.1.1.25 (shikimate dehydrogenase) inhibitor;
EC 1.14.11.2 (procollagen-proline dioxygenase) inhibitor;
human xenobiotic metabolite;
plant metabolite
dihydro-3-coumaric acid[no description available]low00monocarboxylic acidEscherichia coli metabolite;
human xenobiotic metabolite
2-(3-pyridine)acetic acid[no description available]low00monocarboxylic acid;
pyridines		human xenobiotic metabolite
adipic acid[no description available]low00alpha,omega-dicarboxylic acid;
dicarboxylic fatty acid		food acidity regulator;
human xenobiotic metabolite
benzoic acid[no description available]low00benzoic acidsalgal metabolite;
antimicrobial food preservative;
drug allergen;
EC 1.13.11.33 (arachidonate 15-lipoxygenase) inhibitor;
EC 3.1.1.3 (triacylglycerol lipase) inhibitor;
human xenobiotic metabolite;
plant metabolite
3-cresol[no description available]low00cresolhuman xenobiotic metabolite
gallic acid[no description available]low00trihydroxybenzoic acidantineoplastic agent;
antioxidant;
apoptosis inducer;
astringent;
cyclooxygenase 2 inhibitor;
EC 1.13.11.33 (arachidonate 15-lipoxygenase) inhibitor;
geroprotector;
human xenobiotic metabolite;
plant metabolite
diethyl phosphate[no description available]low00dialkyl phosphatehuman xenobiotic metabolite;
mouse metabolite
o,o-diethyl phosphorothionate[no description available]low00organic thiophosphatehuman xenobiotic metabolite;
mouse metabolite
hydroquinone[no description available]low00benzenediol;
hydroquinones		antioxidant;
carcinogenic agent;
cofactor;
Escherichia coli metabolite;
human xenobiotic metabolite;
mouse metabolite;
skin lightening agent
melilotic acid[no description available]low00monocarboxylic acid;
phenols		bacterial xenobiotic metabolite;
fungal xenobiotic metabolite;
human xenobiotic metabolite;
plant metabolite
norepinephrine, (+,-)-isomer[no description available]low00catecholaminehuman xenobiotic metabolite
4-nitrophenol[no description available]low004-nitrophenolshuman xenobiotic metabolite;
mouse metabolite
pentachlorophenol[no description available]low00aromatic fungicide;
chlorophenol;
organochlorine pesticide;
pentachlorobenzenes		human xenobiotic metabolite
phenol[no description available]low00phenolsantiseptic drug;
disinfectant;
human xenobiotic metabolite;
mouse metabolite
phthalic acid[no description available]low00benzenedicarboxylic acidhuman xenobiotic metabolite
propylene glycol[no description available]low00glycol;
propane-1,2-diols		allergen;
human xenobiotic metabolite;
mouse metabolite;
protic solvent
trimethylamine[no description available]low00methylamines;
tertiary amine		Escherichia coli metabolite;
human xenobiotic metabolite
mandelic acid[no description available]low002-hydroxy monocarboxylic acid;
benzenes		antibacterial agent;
human xenobiotic metabolite
dichlorodiphenyl dichloroethylene[no description available]low00chlorophenylethylene;
monochlorobenzenes		human xenobiotic metabolite;
persistent organic pollutant
quinone[no description available]low001,4-benzoquinonescofactor;
human xenobiotic metabolite;
mouse metabolite
1,7-dimethylxanthine[no description available]low00dimethylxanthinecentral nervous system stimulant;
human blood serum metabolite;
human xenobiotic metabolite;
mouse metabolite
psilocin[no description available]low00hydroxyindoles;
phenols;
tertiary amino compound;
tryptamine alkaloid		drug metabolite;
fungal metabolite;
hallucinogen;
human xenobiotic metabolite;
serotonergic agonist
estriol[no description available]low0016alpha-hydroxy steroid;
17beta-hydroxy steroid;
3-hydroxy steroid		estrogen;
human metabolite;
human xenobiotic metabolite;
mouse metabolite
tert-butyl alcohol[no description available]low00tertiary alcoholhuman xenobiotic metabolite
trifluoroacetic acid[no description available]low00fluoroalkanoic acidhuman xenobiotic metabolite;
NMR chemical shift reference compound;
reagent
2-furoic acid[no description available]low00furoic acidbacterial xenobiotic metabolite;
human xenobiotic metabolite;
inhibitor;
plant metabolite;
Saccharomyces cerevisiae metabolite
1-naphthol[no description available]low00naphtholgenotoxin;
human xenobiotic metabolite
2-phenylbutyric acid[no description available]low00benzenes;
monocarboxylic acid		human xenobiotic metabolite
benzohydrol[no description available]low00benzyl alcohols;
secondary alcohol		bacterial xenobiotic metabolite;
human urinary metabolite;
human xenobiotic metabolite;
rat metabolite
(3,4-dimethoxyphenyl)acetic acid[no description available]low00dimethoxybenzene;
phenylacetic acids		human urinary metabolite;
human xenobiotic metabolite
styrene oxide[no description available]low00epoxidehuman xenobiotic metabolite
3-toluic acid[no description available]low00methylbenzoic acidhuman xenobiotic metabolite
gamma-terpinene[no description available]low00cyclohexadiene;
monoterpene		antioxidant;
human xenobiotic metabolite;
plant metabolite;
volatile oil component
cyclamic acid[no description available]low00sulfamic acidsenvironmental contaminant;
human xenobiotic metabolite
4-bromophenol[no description available]low00bromophenolhuman urinary metabolite;
human xenobiotic metabolite;
marine metabolite;
mouse metabolite;
persistent organic pollutant;
rat metabolite
acrolein[no description available]low00enalherbicide;
human xenobiotic metabolite;
toxin
gamma-valerolactone[no description available]low00butan-4-olideflavouring agent;
human xenobiotic metabolite
cyclohexanone[no description available]low00cyclohexanoneshuman xenobiotic metabolite
2,5-hexanedione[no description available]low00diketone;
methyl ketone		human xenobiotic metabolite;
neurotoxin
diethanolamine[no description available]low00ethanolamineshuman xenobiotic metabolite
3,4,5-trimethoxybenzoic acid[no description available]medium00benzoic acids;
methoxybenzenes		human urinary metabolite;
human xenobiotic metabolite;
plant metabolite
3-tert-butyl-4-hydroxyanisole[no description available]low00aromatic ether;
phenols		antioxidant;
human xenobiotic metabolite
1-naphthylamine[no description available]low00naphthylaminehuman xenobiotic metabolite
2-naphthol[no description available]low00naphtholantinematodal drug;
genotoxin;
human urinary metabolite;
human xenobiotic metabolite;
mouse metabolite;
radical scavenger
salicylurate[no description available]low00N-acylglycine;
secondary carboxamide		human xenobiotic metabolite;
uremic toxin
indole-3-carbaldehyde[no description available]low00heteroarenecarbaldehyde;
indole alkaloid;
indoles		bacterial metabolite;
human xenobiotic metabolite;
marine metabolite;
plant metabolite
hydratropic acid[no description available]low002-arylpropionic acidhuman xenobiotic metabolite
tropic acid[no description available]low003-hydroxy monocarboxylic acidhuman xenobiotic metabolite
2-hydroxyisobutyric acid[no description available]low002-hydroxy monocarboxylic acidhuman xenobiotic metabolite
mandelic acid, (r)-isomer[no description available]low00mandelic acidhuman xenobiotic metabolite
2-phenyl-2-propanol[no description available]low00benzyl alcohols;
tertiary alcohol		human xenobiotic metabolite;
Mycoplasma genitalium metabolite
3-hydroxybenzeneacetic acid[no description available]low00monocarboxylic acid;
phenols		human xenobiotic metabolite
methoxyacetic acid[no description available]low00ether;
monocarboxylic acid		antineoplastic agent;
apoptosis inducer;
human xenobiotic metabolite;
mutagen
dihydroferulic acid[no description available]low00guaiacols;
monocarboxylic acid;
phenylpropanoid		antioxidant;
human xenobiotic metabolite;
mouse metabolite;
plant metabolite
1,6-diaminohexane[no description available]low00alkane-alpha,omega-diaminehuman xenobiotic metabolite
phenoxyacetic acid[no description available]low00aromatic ether;
monocarboxylic acid		allergen;
Aspergillus metabolite;
human xenobiotic metabolite;
plant growth retardant
3-phenoxybenzoic acid[no description available]low00phenoxybenzoic acidhuman xenobiotic metabolite;
marine xenobiotic metabolite
3,5,6-trichloro-2-pyridinol[no description available]low00chloropyridine;
hydroxypyridine;
pyridone		human urinary metabolite;
human xenobiotic metabolite;
marine xenobiotic metabolite
dimethyldiselenide[no description available]low00organoselenium compoundbacterial metabolite;
human xenobiotic metabolite;
mammalian metabolite;
plant metabolite
estetrol[no description available]low0015alpha-hydroxy steroid;
16alpha-hydroxy steroid;
17beta-hydroxy steroid;
3-hydroxy steroid;
steroid hormone		estrogen receptor agonist;
estrogen;
human metabolite;
human xenobiotic metabolite;
oral contraceptive
1-methyl-4-phenylpyridinium[no description available]low00pyridinium ionapoptosis inducer;
herbicide;
human xenobiotic metabolite;
neurotoxin
4-vinylphenol[no description available]low00phenolshuman urinary metabolite;
human xenobiotic metabolite
7-hydroxydehydroepiandrosterone[no description available]low0017-oxo steroid;
3beta-hydroxy-Delta(5)-steroid;
7alpha-hydroxy steroid;
androstanoid		anti-inflammatory agent;
antioxidant;
estrogen;
human xenobiotic metabolite;
rat metabolite
7-methylxanthine[no description available]low00oxopurine;
purine alkaloid		human xenobiotic metabolite;
mouse metabolite;
plant metabolite
1-methyluric acid[no description available]low00oxopurinehuman xenobiotic metabolite;
mouse metabolite
6-methylthioguanine[no description available]low002-aminopurines;
thiopurine		human xenobiotic metabolite
phenylsulfate[no description available]low00aryl sulfatehuman xenobiotic metabolite
1,3,7,9-tetramethyluric acid[no description available]low00oxopurine;
purine alkaloid		analgesic;
anti-inflammatory agent;
human xenobiotic metabolite;
plant metabolite
mono-n-octyl phthalate[no description available]low00phthalic acid monoesterhuman xenobiotic metabolite
1,3,7-trimethylurate[no description available]low00oxopurinehuman blood serum metabolite;
human urinary metabolite;
human xenobiotic metabolite;
mouse metabolite
n-hydroxy-4-aminobiphenyl[no description available]low00aminobiphenyl;
N-substituted amine		carcinogenic agent;
human xenobiotic metabolite
4-methylumbelliferyl sulfate[no description available]low00aryl sulfate;
coumarins		human xenobiotic metabolite
trimethylselenonium[no description available]low00organic cationhuman xenobiotic metabolite
1,7-dimethyluric acid[no description available]low00oxopurinehuman xenobiotic metabolite;
mouse metabolite
aspartyl-phenylalanine[no description available]low00dipeptidehuman blood serum metabolite;
human xenobiotic metabolite
1,2,3,4-tetrahydro-beta-carboline-3-carboxylic acid[no description available]low00alpha-amino acid;
aromatic amino acid;
beta-carboline alkaloid		human urinary metabolite;
human xenobiotic metabolite;
plant metabolite;
rat metabolite
aflatoxin q1[no description available]low00aflatoxin;
aromatic ether;
aromatic ketone		carcinogenic agent;
human xenobiotic metabolite
androsta-1,4,6-triene-3,17-dione[no description available]low0017-oxo steroid;
3-oxo-Delta(1),Delta(4)-steroid;
androstanoid		EC 1.14.14.14 (aromatase) inhibitor;
human xenobiotic metabolite
2-hydroxyamino-1-methyl-6-phenylimidazo(4,5-b)pyridine[no description available]low00hydroxylamine;
imidazopyridine		carcinogenic agent;
genotoxin;
human xenobiotic metabolite;
mouse metabolite;
mutagen;
neurotoxin;
rat metabolite
11-hydroxytestosterone[no description available]low0011beta-hydroxy steroid;
17beta-hydroxy steroid;
3-oxo-Delta(4) steroid;
androstanoid;
C19-steroid		bacterial xenobiotic metabolite;
human xenobiotic metabolite;
marine metabolite
mono(2-ethyl-5-oxohexyl)phthalate[no description available]low00methyl ketone;
phthalic acid monoester		human urinary metabolite;
human xenobiotic metabolite
eseroline[no description available]low00phenols;
pyrroloindole		human xenobiotic metabolite;
opioid analgesic
2-(s-glutathionyl)hydroquinone[no description available]low00aryl sulfide;
glutathione conjugate;
hydroquinones		human xenobiotic metabolite;
nephrotoxic agent
tyramine o-sulfate[no description available]low00aryl sulfate;
primary amino compound;
zwitterion		human urinary metabolite;
human xenobiotic metabolite
5,6-didehydrosparteine[no description available]low00organic heterotetracyclic compound;
quinolizidine alkaloid;
tertiary amino compound		human xenobiotic metabolite
methanearsonous acid[no description available]low00arsonous acids;
one-carbon compound		carcinogenic agent;
human xenobiotic metabolite;
poison
methylselenic acid[no description available]low00one-carbon compound;
organoselenium compound		antineoplastic agent;
EC 3.5.1.98 (histone deacetylase) inhibitor;
human xenobiotic metabolite
glycyrrhetyl 3-monoglucuronide[no description available]low00beta-D-glucosiduronic acid;
enone;
monosaccharide derivative;
oxo dicarboxylic acid;
pentacyclic triterpenoid;
triterpenoid saponin		anti-allergic agent;
EC 1.1.1.146 (11beta-hydroxysteroid dehydrogenase) inhibitor;
human xenobiotic metabolite;
plant metabolite;
sweetening agent
13,14-dihydro-15-ketoprostaglandin e1[no description available]low00prostaglandins Ehuman xenobiotic metabolite
mono(2-ethyl-5-hydroxyhexyl) phthalate[no description available]low00phthalic acid monoesterhuman urinary metabolite;
human xenobiotic metabolite
n(4)-hydroxycytidine[no description available]low00ketoxime;
nucleoside analogue		anticoronaviral agent;
antiviral agent;
drug metabolite;
human xenobiotic metabolite
(-)-gallocatechin gallate[no description available]low00catechin;
gallate ester;
polyphenol		antineoplastic agent;
EC 3.4.22.69 (SARS coronavirus main proteinase) inhibitor;
human xenobiotic metabolite;
plant metabolite
hydroxydione[no description available]low0020-oxo steroid;
21-hydroxy steroid;
3-oxo-5beta-steroid;
primary alpha-hydroxy ketone		human xenobiotic metabolite
3,4-dihydroxyphenylpropionic acid[no description available]low00(dihydroxyphenyl)propanoic acidantioxidant;
human xenobiotic metabolite
indole-3-acetonitrile[no description available]low00indoles;
nitrile		auxin;
human xenobiotic metabolite;
plant hormone;
plant metabolite
3,4-didehydroretinoic acid[no description available]low00retinoid;
vitamin A		human xenobiotic metabolite
benzoylecgonine[no description available]low00benzoate ester;
tropane alkaloid		epitope;
human xenobiotic metabolite;
marine xenobiotic metabolite;
plant metabolite
sodium benzoate[no description available]low00organic sodium saltalgal metabolite;
antimicrobial food preservative;
drug allergen;
EC 1.13.11.33 (arachidonate 15-lipoxygenase) inhibitor;
EC 3.1.1.3 (triacylglycerol lipase) inhibitor;
human xenobiotic metabolite;
plant metabolite
11-hydroxy-delta(9)-tetrahydrocannabinol[no description available]low00phytocannabinoidhuman xenobiotic metabolite
n-methylthiourea[no description available]low00thioureasdrug metabolite;
hepatotoxic agent;
human xenobiotic metabolite
4-nitrocatechol[no description available]low00C-nitro compound;
catechols		human xenobiotic metabolite;
lipoxygenase inhibitor
hydroxypioglitazone[no description available]low00aromatic ether;
pyridines;
thiazolidinediones		human xenobiotic metabolite
retinol palmitate[no description available]low00all-trans-retinyl ester;
retinyl palmitate		antioxidant;
Escherichia coli metabolite;
human xenobiotic metabolite
kaempferol[no description available]low007-hydroxyflavonol;
flavonols;
tetrahydroxyflavone		antibacterial agent;
geroprotector;
human blood serum metabolite;
human urinary metabolite;
human xenobiotic metabolite;
plant metabolite
leukotriene b5[no description available]low00dihydroxy monocarboxylic acid;
hydroxy polyunsaturated fatty acid;
leukotriene;
long-chain fatty acid		anti-inflammatory agent;
human xenobiotic metabolite;
rat metabolite
5,15-dihydroxy-6,8,11,13-eicosatetraenoic acid[no description available]low00dihydroxyicosatetraenoic acidhuman xenobiotic metabolite;
rat metabolite
arachidonic acid 5-hydroperoxide[no description available]low00HPETEhuman xenobiotic metabolite
ethyl arachidonate[no description available]low00long-chain fatty acid ethyl esterhuman blood serum metabolite;
human xenobiotic metabolite
trandolaprilat[no description available]low00dicarboxylic acid;
dipeptide;
organic heterobicyclic compound;
secondary amino compound;
tertiary carboxamide		antihypertensive agent;
drug metabolite;
EC 3.4.15.1 (peptidyl-dipeptidase A) inhibitor;
human xenobiotic metabolite
25-hydroxyvitamin d 2[no description available]low00hydroxycalciol;
seco-ergostane;
vitamin D		bone density conservation agent;
human xenobiotic metabolite;
nutraceutical
vitamin a2[no description available]low00retinoid;
vitamin A		human xenobiotic metabolite;
marine xenobiotic metabolite;
mouse metabolite
4-oxoretinoic acid[no description available]low00enone;
retinoid		human xenobiotic metabolite
15-hydroperoxy-5,8,11,13-eicosatetraenoic acid[no description available]low00HPETEhuman xenobiotic metabolite
5-oxo-15-hydroxy-6,8,11,13-eicosatetraenoic acid[no description available]low00enone;
hydroxy polyunsaturated fatty acid;
icosanoid;
long-chain fatty acid;
oxo fatty acid;
secondary allylic alcohol		human xenobiotic metabolite
5,12-dihydroxy-6,8,14-eicosatrienoic acid[no description available]low00dihydroxy monocarboxylic acid;
hydroxy polyunsaturated fatty acid;
leukotriene;
long-chain fatty acid		human urinary metabolite;
human xenobiotic metabolite
17-hydroxy-4,7,10,13,15,19-docosahexaenoic acid[no description available]low00hydroxydocosahexaenoic acid;
secondary allylic alcohol		human xenobiotic metabolite
riddelliine n-oxide[no description available]low00diol;
macrocyclic lactone;
olefinic compound;
organic heterotricyclic compound;
primary alcohol;
pyrrolizine alkaloid;
tertiary alcohol;
tertiary amine oxide		carcinogenic agent;
genotoxin;
human xenobiotic metabolite;
Jacobaea metabolite;
mutagen;
rat metabolite
meso-zeaxanthin[no description available]low00carotenolanti-inflammatory agent;
antioxidant;
human xenobiotic metabolite;
marine metabolite
13(S)-HODE[no description available]low00HODEantineoplastic agent;
human xenobiotic metabolite;
mouse metabolite
3-hydroxyphenylacetate[no description available]low00hydroxy monocarboxylic acid anionhuman xenobiotic metabolite
1,25-dihydroxyergocalciferol[no description available]low00hydroxycalciol;
seco-ergostane;
vitamin D		bone density conservation agent;
human xenobiotic metabolite;
nutraceutical
demethylmirtazapine[no description available]low00benzazepine;
tetracyclic antidepressant		alpha-adrenergic antagonist;
anxiolytic drug;
H1-receptor antagonist;
histamine antagonist;
human xenobiotic metabolite;
serotonergic antagonist
5s,12r,18r-trihydroxy-6z,8e,10e,14z,16e-eicosapentaenoic acid[no description available]low00hydroxy polyunsaturated fatty acid;
long-chain fatty acid;
nonclassic icosanoid;
resolvin;
triol		anti-inflammatory agent;
human xenobiotic metabolite
resolvin d2[no description available]low00hydroxy polyunsaturated fatty acid;
resolvin;
secondary allylic alcohol;
triol		anti-inflammatory agent;
anti-obesity agent;
estrogen receptor agonist;
human xenobiotic metabolite;
rat metabolite
aflatoxin m1[no description available]low00aflatoxin;
aromatic ether;
aromatic ketone;
tertiary alcohol		Aspergillus metabolite;
human xenobiotic metabolite;
mammalian metabolite
protectin d1[no description available]low00dihydroxydocosahexaenoic acid;
protectin;
secondary allylic alcohol		anti-inflammatory agent;
apoptosis inhibitor;
hepatoprotective agent;
human xenobiotic metabolite;
neuroprotective agent;
PPARgamma agonist;
specialised pro-resolving mediator
resolvin e2[no description available]low00diol;
hydroxy polyunsaturated fatty acid;
resolvin;
secondary allylic alcohol		anti-inflammatory agent;
human xenobiotic metabolite;
rat metabolite
11,12-epoxy-5,8,14-eicosatrienoic acid[no description available]low0011,12-EEThuman xenobiotic metabolite
resolvin D4[no description available]low00hydroxy polyunsaturated fatty acid;
resolvin;
secondary allylic alcohol;
triol		anti-inflammatory agent;
human xenobiotic metabolite
resolvin d3[no description available]low00hydroxy polyunsaturated fatty acid;
resolvin;
secondary allylic alcohol;
triol		anti-inflammatory agent;
human xenobiotic metabolite
2-hydroxyatrazine[no description available]low00diamino-1,3,5-triazine;
monohydroxy-1,3,5-triazine		human xenobiotic metabolite;
marine xenobiotic metabolite
tyrphostin a1[no description available]low00methoxybenzenesgeroprotector
anethole trithione[no description available]low00methoxybenzenes
capsaicin[no description available]low00methoxybenzenes;
phenols
dilazep[no description available]low00benzoate ester;
diazepane;
diester;
methoxybenzenes		cardioprotective agent;
platelet aggregation inhibitor;
vasodilator agent
guaifenesin[no description available]low00methoxybenzenes
mefexamide[no description available]low00methoxybenzenes
mescaline[no description available]low00methoxybenzenes;
phenethylamine alkaloid;
primary amino compound		hallucinogen
mofezolac[no description available]low00methoxybenzenes
4-(3-butoxy-4-methoxybenzyl)-2-imidazolidinone[no description available]low00methoxybenzenes
thonzylamine[no description available]low00methoxybenzenes
trimethoprim[no description available]low00aminopyrimidine;
methoxybenzenes		antibacterial drug;
diuretic;
drug allergen;
EC 1.5.1.3 (dihydrofolate reductase) inhibitor;
environmental contaminant;
xenobiotic
thonzylamine monohydrochloride[no description available]low00methoxybenzenes
mephenoxalone[no description available]low00methoxybenzenes
N-(2-methoxyphenyl)acetamide[no description available]low00acetamides;
methoxybenzenes
creosol[no description available]low00methoxybenzenes;
phenols
2-methyl-4-methoxyaniline[no description available]low00methoxybenzenes
4-methyl anisole[no description available]low00methoxybenzenes
4-anisidine[no description available]low00methoxybenzenes;
primary amino compound;
substituted aniline		genotoxin;
reagent
cresidine[no description available]low00methoxybenzenes
mequinol[no description available]low00methoxybenzenes;
phenols		metabolite
ethamivan[no description available]low00methoxybenzenes;
phenols
topanol 354[no description available]low00methoxybenzenes;
phenols
phloroglucinol dimethyl ether[no description available]low00methoxybenzenes;
phenols
methoxyhydroxyphenylglycol[no description available]low00methoxybenzenes;
phenols
paeonol[no description available]low00methoxybenzenes;
phenols		metabolite
guaiacol carbonate[no description available]low00methoxybenzenes
4-methoxy-3-phenylenediamine[no description available]low00methoxybenzenes
1,2,3-trimethoxybenzene[no description available]low00methoxybenzenesplant metabolite
propanidid[no description available]low00methoxybenzenes
3-methoxy-4-hydroxyphenylethanol[no description available]low00methoxybenzenes;
phenols
dimethophrine[no description available]low00methoxybenzenes;
phenols
4-vinyl-2,6-dimethoxyphenol[no description available]low00methoxybenzenes;
phenols
arildone[no description available]low00methoxybenzenes
meobentine[no description available]low00methoxybenzenes
4-(4-Methoxyphenyl)-2-butanone[no description available]low00methoxybenzenes
4-ethylguaiacol[no description available]low00methoxybenzenes;
phenols
trithiozine[no description available]low00methoxybenzenes
1,2,4-trimethoxybenzene[no description available]low00methoxybenzenes
g 29505[no description available]low00methoxybenzenes
brodimoprim[no description available]low00aminopyrimidine;
bromobenzenes;
methoxybenzenes		antibacterial drug;
antiinfective agent;
EC 1.5.1.3 (dihydrofolate reductase) inhibitor
2-hydroxy-4-methoxybenzaldehyde[no description available]low00methoxybenzenes;
phenols
4-iodoanisole[no description available]low00methoxybenzenes
moprolol[no description available]low00methoxybenzenes
vanitiolide[no description available]low00methoxybenzenes;
phenols
2,5-di-tert-butyl-4-hydroxyanisole[no description available]low00methoxybenzenes;
phenols
zinniol[no description available]low00methoxybenzenes
sr 95531[no description available]low00methoxybenzenes
2-o-methylpyrogallol[no description available]low00methoxybenzenes;
phenols
cilomilast[no description available]low00methoxybenzenes
4'-demethyldesoxypodophyllotoxin[no description available]low00furonaphthodioxole;
gamma-lactone;
lignan;
methoxybenzenes;
phenols		antineoplastic agent;
antioxidant;
immunosuppressive agent;
plant metabolite
myricanone[no description available]low00aromatic ether;
cyclic ketone;
diarylheptanoid;
methoxybenzenes;
phenols		antineoplastic agent;
plant metabolite
nordihydrocapsaicin[no description available]low00methoxybenzenes;
phenols
isomhpg[no description available]low00methoxybenzenes;
phenols
n-demethyltramadol[no description available]low00methoxybenzenes
5-(3,4,5-trimethoxyphenyl)-3H-1,3,4-oxadiazol-2-one[no description available]low00methoxybenzenes
anthricin[no description available]low00furonaphthodioxole;
gamma-lactone;
lignan;
methoxybenzenes		antineoplastic agent;
apoptosis inducer;
plant metabolite
7-(4-methoxyphenyl)-5-phenyl-1,7-dihydrotetrazolo[1,5-a]pyrimidine[no description available]low00methoxybenzenes
knipholone[no description available]low00aromatic ketone;
dihydroxyanthraquinone;
methoxybenzenes;
methyl ketone;
polyphenol;
resorcinols		antineoplastic agent;
antioxidant;
antiplasmodial drug;
leukotriene antagonist;
metabolite
yatein[no description available]low00benzodioxoles;
butan-4-olide;
lignan;
methoxybenzenes		plant metabolite
8-(2-chloro-3,4,5-trimethoxybenzyl)-2-fluoro-9-pent-4-yn-1-yl-9H-purin-6-amine[no description available]low006-aminopurines;
acetylenic compound;
methoxybenzenes;
monochlorobenzenes;
organofluorine compound		antineoplastic agent;
Hsp90 inhibitor
chavibetol[no description available]low00methoxybenzenes;
phenols
6-amino-4-(2-methoxyphenyl)-3-propyl-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile[no description available]low00methoxybenzenes;
pyranopyrazole
6-amino-4-[4-(2-amino-2-oxoethoxy)-2-chloro-5-methoxyphenyl]-5-cyano-2-methyl-4H-pyran-3-carboxylic acid methyl ester[no description available]low00methoxybenzenes
N-butyl-N-[5-(3,4,5-trimethoxyphenyl)-1,3,4-thiadiazol-2-yl]-2-furancarboxamide[no description available]low00methoxybenzenes
2-(ethylthio)-5-(4-methoxyphenyl)-1,3,4-oxadiazole[no description available]low00methoxybenzenes
6-amino-3-(methoxymethyl)-4-(4-methoxyphenyl)-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile[no description available]low00methoxybenzenes;
pyranopyrazole
5-(4-methoxyphenyl)-7-(4-methylphenyl)-1,7-dihydrotetrazolo[1,5-a]pyrimidine[no description available]low00methoxybenzenes
5-(4-bromophenyl)-4-(4-hydroxy-3-methoxyphenyl)-3-methyl-2,4-dihydropyrrolo[3,4-c]pyrazol-6-one[no description available]low00methoxybenzenes;
phenols
3-(2-furanylmethyl)-8-(4-methoxyphenyl)-6-oxo-2,4,7,8-tetrahydropyrido[2,1-b][1,3,5]thiadiazine-9-carbonitrile[no description available]low00methoxybenzenes
2-methoxy-6-[[(1-propyl-5-benzimidazolyl)amino]methyl]phenol[no description available]low00methoxybenzenes;
phenols
1-(4-Methoxyphenyl)-2-nitroethylene[no description available]low00methoxybenzenes
5-(5-chloro-2-methoxyphenyl)-3H-1,3,4-oxadiazole-2-thione[no description available]low00methoxybenzenes
brd32048[no description available]low00methoxybenzenes;
substituted aniline
2-methoxy-6-[[(1-methyl-2-benzimidazolyl)amino]methyl]phenol[no description available]low00methoxybenzenes;
phenols
4-chloro-N-(3,4,5-trimethoxyphenyl)-5-dithiazolimine[no description available]low00methoxybenzenes;
substituted aniline
(1E,4E)-1,5-bis(4-methoxyphenyl)penta-1,4-dien-3-one[no description available]low00methoxybenzenes
5-amino-3-(4-methoxyphenyl)-4-oxo-1-thieno[3,4-d]pyridazinecarboxylic acid ethyl ester[no description available]low00methoxybenzenes;
substituted aniline
(4-methoxyphenyl)-(4-methyl-1-piperazinyl)methanethione[no description available]low00methoxybenzenes
(3-bromo-4-methoxyphenyl)-(4-methyl-1-piperazinyl)methanethione[no description available]low00methoxybenzenes
2-propyl-5-(3,4,5-trimethoxyphenyl)-1,3,4-oxadiazole[no description available]low00methoxybenzenes
1-azepanyl-(4-methoxyphenyl)methanethione[no description available]low00methoxybenzenes
1-[[(1,5-dimethyl-3-pyrazolyl)-oxomethyl]amino]-3-(2-methoxyphenyl)thiourea[no description available]low00methoxybenzenes;
substituted aniline
1-(4-methoxyphenyl)-3-[[oxo(thiophen-2-yl)methyl]amino]thiourea[no description available]low00methoxybenzenes;
substituted aniline
N2,N4-bis(4-methoxyphenyl)pyrimidine-2,4-diamine[no description available]low00methoxybenzenes;
substituted aniline
2-(4-methoxyphenyl)-5-(3-pyridinyl)-1,3,4-oxadiazole[no description available]low00methoxybenzenes
2-(2-methoxyphenoxy)-N-[(2-methoxyphenyl)methyl]acetamide[no description available]low00methoxybenzenes
N4-(4-methoxyphenyl)-1,3,5-triazaspiro[5.5]undeca-1,4-diene-2,4-diamine[no description available]low00methoxybenzenes;
substituted aniline
4-mercapto-5-(4-methoxyphenyl)-2-oxo-1,5-diazaspiro[5.5]undec-3-ene-3-carbonitrile[no description available]low00methoxybenzenes;
substituted aniline
4-[2-(3-methoxyanilino)-4-thiazolyl]phenol[no description available]low00methoxybenzenes;
substituted aniline
N-(3-chloro-4-methoxyphenyl)-4,6-dimethoxy-1,3,5-triazin-2-amine[no description available]low00methoxybenzenes;
substituted aniline
N-[3-cyano-4-(4-methoxyphenyl)-5-methyl-2-thiophenyl]-2-methyl-3-pyrazolecarboxamide[no description available]low00methoxybenzenes
5-[(3,5-dimethyl-4-nitro-1-pyrazolyl)methyl]-N-[(4-methoxyphenyl)methyl]-2-furancarboxamide[no description available]low00methoxybenzenes
N-cyclohexyl-2-[[5-[(4-methoxyphenyl)methyl]-4-methyl-1,2,4-triazol-3-yl]thio]acetamide[no description available]low00methoxybenzenes
2-[[5-[(4-methoxyphenyl)methyl]-1,3,4-oxadiazol-2-yl]thio]-N-(4-methyl-2-thiazolyl)acetamide[no description available]low00methoxybenzenes
6-[[(4,6-dimethyl-2-pyrimidinyl)thio]methyl]-N2-(4-methoxyphenyl)-1,3,5-triazine-2,4-diamine[no description available]low00methoxybenzenes;
substituted aniline
3-(4-methoxyphenyl)-2-(4-methoxyphenyl)imino-4-thiazolidinone[no description available]low00methoxybenzenes;
substituted aniline
N-[5-(4-methoxyphenyl)-1,3,4-thiadiazol-2-yl]-5-methyl-3-isoxazolecarboxamide[no description available]low00methoxybenzenes
N-[5-(2-methoxyphenyl)-1,3,4-thiadiazol-2-yl]carbamic acid methyl ester[no description available]low00methoxybenzenes
3-(4-methoxyphenyl)-2,4-dihydrothiazolo[3,2-a][1,3,5]triazin-6-one[no description available]low00methoxybenzenes;
substituted aniline
N-[5-[(4-methoxyphenyl)methyl]-1,3,4-thiadiazol-2-yl]-2-furancarboxamide[no description available]low00methoxybenzenes
zucapsaicin[no description available]low00methoxybenzenes;
phenols
N-[[[2-(2-methoxyphenoxy)-1-oxoethyl]hydrazo]-sulfanylidenemethyl]-2-furancarboxamide[no description available]low00methoxybenzenes
1-(3-methoxyphenyl)-3-[[3-(4-nitro-1-pyrazolyl)-1-oxopropyl]amino]thiourea[no description available]low00methoxybenzenes;
substituted aniline
N-(5-chloro-2-methoxyphenyl)-5-pyridin-4-yl-1,3,4-thiadiazol-2-amine[no description available]low00methoxybenzenes;
substituted aniline
2-[(6-amino-3,5-dicyano-4-thiophen-2-yl-2-pyridinyl)thio]-N-[(2-methoxyphenyl)methyl]acetamide[no description available]low00methoxybenzenes
1-[[(4-bromo-2-methyl-3-pyrazolyl)-oxomethyl]amino]-3-(2-methoxy-5-methylphenyl)thiourea[no description available]low00methoxybenzenes;
substituted aniline
1-[2-(2-chlorophenoxy)ethoxy]-2-methoxy-4-methylbenzene[no description available]low00methoxybenzenes
1-chloro-2-[2-(2-methoxy-4-methylphenoxy)ethoxy]-4-methylbenzene[no description available]low00methoxybenzenes
N-[2-(4-methoxyphenyl)ethyl]-2,3-dihydro-1,4-dioxin-5-carboxamide[no description available]low00methoxybenzenes
2-(4-methoxyphenyl)-5-(2-methylpropylthio)-1,3,4-oxadiazole[no description available]low00methoxybenzenes
1-[2-[[5-(2-methoxyanilino)-1,3,4-thiadiazol-2-yl]thio]-1-oxoethyl]-2-pyrrolidinone[no description available]low00methoxybenzenes;
substituted aniline
4-(2-furanylmethyl)-3-[(3-methoxyphenyl)methyl]-1H-1,2,4-triazole-5-thione[no description available]low00methoxybenzenes
1-(3-methoxyphenyl)-3-(methyl-oxo-phenyl-$l^{6}-sulfanylidene)thiourea[no description available]low00methoxybenzenes;
substituted aniline
2-amino-7-methyl-5-oxo-4-(2,3,4-trimethoxyphenyl)-4,6,7,8-tetrahydro-1-benzopyran-3-carbonitrile[no description available]low00methoxybenzenes
2-amino-7-methyl-5-oxo-4-(2,4,5-trimethoxyphenyl)-4,6,7,8-tetrahydro-1-benzopyran-3-carbonitrile[no description available]low00methoxybenzenes
4-(4-hydroxy-3-methoxyphenyl)-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylic acid (3-methylcyclohexyl) ester[no description available]low00methoxybenzenes;
phenols
4-(4-hydroxy-3-methoxyphenyl)-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylic acid (4-methoxyphenyl)methyl ester[no description available]low00methoxybenzenes;
phenols
N'-[(4-methoxyphenyl)methyl]-N-phenylcarbamimidothioic acid (2,5-dioxo-3-pyrrolidinyl) ester[no description available]low00methoxybenzenes
1-ethoxy-3-(2-methoxy-4-prop-2-enylphenoxy)-2-propanol[no description available]low00methoxybenzenes
2-(1-adamantyl)-5-(4-ethoxy-3-methoxyphenyl)-5,6-dihydro-[1,2,4]triazolo[5,1-b][1,3]thiazin-7-one[no description available]low00methoxybenzenes
2-(3,5-diphenyl-3,4-dihydropyrazol-2-yl)-2-(4-hydroxy-3-methoxyphenyl)acetonitrile[no description available]low00methoxybenzenes;
phenols
5-(4-methoxyanilino)-2-[(3-methylphenoxy)methyl]-4-oxazolecarbonitrile[no description available]low00methoxybenzenes;
substituted aniline
3-(4-methoxyphenyl)-N-methyl-5-(4-methylphenyl)-3,4-dihydropyrazole-2-carbothioamide[no description available]low00methoxybenzenes
1-[1-[2-(4-methoxyphenyl)ethyl]-2,5-dimethyl-3-pyrrolyl]-2-[(1-methyl-5-tetrazolyl)thio]ethanone[no description available]low00methoxybenzenes
7-(2-methoxyphenyl)-5-phenyl-1,7-dihydrotetrazolo[1,5-a]pyrimidine[no description available]low00methoxybenzenes
2-(4-ethoxy-3-methoxyphenyl)-4-mercapto-3-(4-methoxyphenyl)-6-oxo-1,2-dihydropyrimidine-5-carbonitrile[no description available]low00methoxybenzenes;
substituted aniline
2-[[3-(4-methoxyphenyl)-1,2,4-thiadiazol-5-yl]thio]acetic acid ethyl ester[no description available]low00methoxybenzenes
3-(4-methoxyphenyl)-N-[(4-methoxyphenyl)methyl]-4,5-dihydroisoxazole-5-carboxamide[no description available]low00methoxybenzenes
N-cyclohexyl-3-(3-methoxyphenyl)-4,5-dihydroisoxazole-5-carboxamide[no description available]low00methoxybenzenes
N-(2-methoxyethyl)-5-(3-methoxyphenyl)-3-isoxazolecarboxamide[no description available]low00methoxybenzenes
3-(4-methoxyphenyl)-3-(1-pyrrolyl)-N-(2-thiazolyl)propanamide[no description available]low00methoxybenzenes
5-(4-methoxyphenyl)-N-propan-2-yl-3-isoxazolecarboxamide[no description available]low00methoxybenzenes
N-(2-furanylmethyl)-5-(3-methoxyphenyl)-3-isoxazolecarboxamide[no description available]low00methoxybenzenes
3-(3-methoxyphenyl)-N-(3-pyridinyl)-4,5-dihydroisoxazole-5-carboxamide[no description available]low00methoxybenzenes
2-amino-6-ethyl-4-(4-methoxyphenyl)-8-[(4-methoxyphenyl)methyl]-4,5-dihydropyrano[3,2-c]pyridine-3-carbonitrile[no description available]low00methoxybenzenes
2-(2-methoxyphenyl)-1-methyl-3,5-dinitro-2H-pyridine[no description available]low00methoxybenzenes
N4-(2-furanylmethyl)-N2-(3-methoxyphenyl)-5-nitropyrimidine-2,4,6-triamine[no description available]low00methoxybenzenes;
substituted aniline
4-[(4-ethoxy-3-methoxyphenyl)-(3-methyl-5-oxo-1,2-dihydropyrazol-4-yl)methyl]-5-methyl-1,2-dihydropyrazol-3-one[no description available]low00methoxybenzenes
2-[4-(4-methoxyphenyl)-2-thiazolyl]guanidine[no description available]low00methoxybenzenes
1-(Chloroacetyl)-5-[4-(difluoromethoxy)-3-methoxyphenyl]-3-thien-2-yl-4,5-dihydro-1H-pyrazole[no description available]low00methoxybenzenesanticoronaviral agent
N-[5-(2-methoxyphenyl)-1,3,4-thiadiazol-2-yl]-2-[(4-methyl-1,2,4-triazol-3-yl)thio]acetamide[no description available]low00methoxybenzenes
3-hydroxy-6-(hydroxymethyl)-2-[(3-methoxyphenyl)-(2-pyridinylamino)methyl]-4-pyranone[no description available]low00methoxybenzenes
1-[[2-(2,4-dichlorophenoxy)-1-oxoethyl]amino]-3-(4-methoxyphenyl)thiourea[no description available]low00methoxybenzenes;
substituted aniline
2-[[6-amino-2-(4-methoxyanilino)-5-nitro-4-pyrimidinyl]amino]ethanol[no description available]low00methoxybenzenes;
substituted aniline
1-amino-3-(4-chloro-2-methoxy-5-methylphenyl)thiourea[no description available]low00methoxybenzenes;
substituted aniline
2-[[2-(4-ethoxy-3-methoxyphenyl)-4-thiazolyl]methylthio]-5-methyl-1,3,4-thiadiazole[no description available]low00methoxybenzenes
6-(4-methoxyphenyl)-8-methyl-4-oxo-6H-pyrimido[2,1-b][1,3]thiazine-2,7-dicarboxylic acid O7-ethyl ester O2-methyl ester[no description available]low00methoxybenzenes
1-[2,5-dimethyl-1-(2-oxolanylmethyl)-3-pyrrolyl]-2-[[5-(4-methoxyanilino)-1,3,4-thiadiazol-2-yl]thio]ethanone[no description available]low00methoxybenzenes;
substituted aniline
6-iodonordihydrocapsaicin[no description available]low00methoxybenzenes;
phenols
pterostilbene[no description available]low00diether;
methoxybenzenes;
stilbenol		anti-inflammatory agent;
antineoplastic agent;
antioxidant;
apoptosis inducer;
hypoglycemic agent;
neuroprotective agent;
neurotransmitter;
plant metabolite;
radical scavenger
4-[5-(4-methoxyphenyl)-3-isoxazolyl]-N-(2-pyridinylmethyl)butanamide[no description available]low00methoxybenzenes
olvanil[no description available]low00methoxybenzenes;
phenols
arvanil[no description available]low00methoxybenzenes;
phenols
1-[2-(4-methoxyphenyl)ethyl]-3,5-dimethyl-4-nitropyrazole[no description available]low00methoxybenzenes
mdl 105725[no description available]low00methoxybenzenes;
phenols
n,n-dipropyl-2-(4-methoxy-3-(2-phenylethoxy)phenyl)ethylamine monohydrochloride[no description available]low00aromatic ether;
hydrochloride;
methoxybenzenes;
tertiary amino compound		antipsychotic agent;
receptor modulator
6-[[5-fluoro-2-(3,4,5-trimethoxyanilino)-4-pyrimidinyl]amino]-2,2-dimethyl-4H-pyrido[3,2-b][1,4]oxazin-3-one[no description available]low00methoxybenzenes;
substituted aniline
cardiogenol c[no description available]low00methoxybenzenes;
substituted aniline
3-amino-2-cyano-5-(3-methoxyphenyl)-7-methyl-5H-thiazolo[3,2-a]pyrimidine-6-carboxylic acid methyl ester[no description available]low00methoxybenzenes
N-[5-[2-(2-methoxyanilino)-4-thiazolyl]-4-methyl-2-thiazolyl]-2-methylpentanamide[no description available]low00methoxybenzenes;
substituted aniline
N-[5-[2-(5-chloro-2-methoxyanilino)-4-thiazolyl]-4-methyl-2-thiazolyl]hexanamide[no description available]low00methoxybenzenes;
substituted aniline
N-[5-[2-(3-methoxyanilino)-4-thiazolyl]-4-methyl-2-thiazolyl]-3-methylbutanamide[no description available]low00methoxybenzenes;
substituted aniline
N-[5-[2-(2-methoxyanilino)-4-thiazolyl]-4-methyl-2-thiazolyl]heptanamide[no description available]low00methoxybenzenes;
substituted aniline
N-[5-[2-(2-methoxyanilino)-4-thiazolyl]-4-methyl-2-thiazolyl]pentanamide[no description available]low00methoxybenzenes;
substituted aniline
N-[5-[2-(3-methoxyanilino)-4-thiazolyl]-4-methyl-2-thiazolyl]heptanamide[no description available]low00methoxybenzenes;
substituted aniline
aegeline[no description available]low00methoxybenzenes
siphonazole[no description available]low00methoxybenzenes;
phenols
N-[(2-methoxyphenyl)methyl]-4-[[[2-(4-methyl-1-piperidinyl)-3,4-dioxo-1-cyclobutenyl]amino]methyl]-1-cyclohexanecarboxamide[no description available]low00methoxybenzenes
antrocamphin a[no description available]low00methoxybenzenesanti-inflammatory agent;
metabolite
3-(1,3-benzodioxol-5-yl)-3-(2-hydroxy-4,6-dimethoxyphenyl)-1-(3-methyl-1-piperidinyl)-1-propanone[no description available]low00methoxybenzenes;
phenols
2-[[4-(5-chloro-2-methoxyanilino)-6-(1-piperidinyl)-1,3,5-triazin-2-yl]amino]ethanol[no description available]low00methoxybenzenes;
substituted aniline
2-[[4-(2-methoxyanilino)-6-(1-pyrrolidinyl)-1,3,5-triazin-2-yl]amino]ethanol[no description available]low00methoxybenzenes;
substituted aniline
2-[[4-(3-methoxyanilino)-6-(1-pyrrolidinyl)-1,3,5-triazin-2-yl]amino]ethanol[no description available]low00methoxybenzenes;
substituted aniline
2-[[4-(4-methoxyanilino)-6-(1-pyrrolidinyl)-1,3,5-triazin-2-yl]amino]ethanol[no description available]low00methoxybenzenes;
substituted aniline
n-trans-feruloyloctopamine[no description available]low00methoxybenzenes;
phenols
4-[[4-(2-methoxyanilino)-6-(1-pyrrolidinyl)-1,3,5-triazin-2-yl]amino]-1-butanol[no description available]low00methoxybenzenes;
substituted aniline
[(1R,5S)-6-azabicyclo[3.2.1]octan-6-yl]-[5-[(4-chloro-2-methoxyphenoxy)methyl]-3-isoxazolyl]methanone[no description available]low00methoxybenzenes
5-[(2-chloro-4-methoxyphenoxy)methyl]-N-[(6-methyl-2-pyridinyl)methyl]-3-isoxazolecarboxamide[no description available]low00methoxybenzenes
1-(3-methoxyphenyl)-2-[4-oxo-6-(trifluoromethyl)-1H-pyrimidin-2-yl]guanidine[no description available]low00methoxybenzenes;
substituted aniline
2-[(4-methoxyphenyl)methylthio]-6-methyl-1H-pyrimidin-4-one[no description available]low00methoxybenzenes
bemotrizinol[no description available]low00methoxybenzenes
ConditionIndicatedRelationship StrengthStudiesTrials
Abdominal Pain0medium11
Anemia, Fanconi0low10
Benign Neoplasms0low10
Cancer0low10
Colicky Pain0medium11
Colitis, Mucous0medium21
Colon, Irritable0medium21
Congenital Zika Syndrome0low10
Congenital Zika Virus Infection0low10
Disease Models, Animal0low10
Encephalitis, Polio0low10
Epidemic Acute Poliomyelitis0low10
Fanconi Anemia0low10
Fanconi Hypoplastic Anemia0low10
Fanconi Pancytopenia0low10
Fanconi Panmyelopathy0low10
Fanconi's Anemia0low10
Fever, Zika0low10
Infantile Paralysis0low10
Inflammation0low10
Innate Inflammatory Response0low10
Irritable Bowel Syndrome0medium21
Malignancy0low10
Malignant Neoplasms0low10
Neoplasia0low10
Neoplasm0low10
Neoplasms0low10
Neoplasms, Benign0low10
Polio0low10
Polio Encephalitis0low10
Poliomyelitis0low10
Poliomyelitis Infection0low10
Poliomyelitis, Acute0low10
Poliomyelitis, Nonpoliovirus0low10
Poliomyelitis, Preparalytic0low10
Tumors0low10
Zika Fever0low10
Zika Virus Disease0low10
Zika Virus Infection0low10
ZikV Infection0low10

Research Highlights

Bioavailability (2)

ArticleYear
A High-Throughput Screen of a Library of Therapeutics Identifies Cytotoxic Substrates of P-glycoprotein.
Molecular pharmacology, Volume: 96, Issue: 5		2019
Physiologically relevant orthogonal assays for the discovery of small-molecule modulators of WIP1 phosphatase in high-throughput screens.
The Journal of biological chemistry, 11-15, Volume: 294, Issue: 46		2019
[information is derived through text-mining from research data collected from National Library of Medicine (NLM), extracted Dec-2023]

Dosage (1)

ArticleYear
In vitro availability of trimethylphloroglucinol and its degradation product from dosage formulations by RP-HPLC.
Pakistan journal of pharmaceutical sciences, Volume: 18, Issue: 4		2005
[information is derived through text-mining from research data collected from National Library of Medicine (NLM), extracted Dec-2023]