Page last updated: 2024-09-20

musk ketone

Description

musk ketone: increases activity of glutathione S-transferase and thus may prove to be useful cancer chemoprotectant [Medical Subject Headings (MeSH), National Library of Medicine, extracted Dec-2023]

Cross-References

ID SourceID
PubMed CID6669
CHEMBL ID1877463
CHEBI ID174791
SCHEMBL ID113330
MeSH IDM0098790

Synonyms (84)

Synonym
STK725128
CHEBI:174791
acetophenone, 4'-tert-butyl-2',6'-dimethyl-3',5'-dinitro-
ethanone, 1-[4-(1,1-dimethylethyl)-2,6-dimethyl-3,5-dinitrophenyl]-
2,6-dimethyl-3,5-dinitro-4-tert-butylacetophenone
acetophenone,6'-dimethyl-3',5'-dinitro-
nsc15339
musk ketone
ethanone,1-dimethylethyl)-2,6-dimethyl-3,5-dinitrophenyl]-
4'-tert-butyl-2',5'-dinitroacetophenone
81-14-1
nsc-15339
2-acetyl-5-tert-butyl-4,6-dinitroxylene
einecs 201-328-9
2,6-dimethyl-3,5-dinitro-4-t-butylacetophenone
nsc 15339
ethanone, 1-(4-(1,1-dimethylethyl)-2,6-dimethyl-3,5-dinitrophenyl)-
2,6-dinitro-3,5-dimethyl-4-acetyl-tert-butylbenzene
ccris 4677
4'-tert-butyl-2',6'-dimethyl-3',5'-dinitroacetophenone
1-(4-(1,1-dimethylethyl)-2,6-dimethyl-3,5-dinitrophenyl)ethanone
4-tert-butyl-3,5-dinitro-2,6-dimethylacetophenone
ai3-02440
3,5-dinitro-2,6-dimethyl-4-tert-butylacetophenone
brn 2062638
musk ketone, >=98%
NCGC00164404-01
1-(4-tert-butyl-2,6-dimethyl-3,5-dinitrophenyl)ethanone
ketone moschus, >=97.0% (n)
AC-11085
A840051
1-(4-tert-butyl-2,6-dimethyl-3,5-dinitro-phenyl)ethanone
4-07-00-00808 (beilstein handbook reference)
unii-483v3e1l6j
483v3e1l6j ,
hsdb 7694
dtxsid6025690 ,
cas-81-14-1
dtxcid405690
NCGC00255386-01
tox21_301627
BBL011671
AKOS005524284
FT-0629036
1-tert-butyl-3,5-dimethyl-2,6-dinitro-4-acetylbenzene
musk ketone [hsdb]
musk ketone [inci]
2,6 dimethyl-4-tert-butyl-3,5-dinitroacetophenone
4-tert-butyl-2,6-dimethyl-3,5-dinitroacetophenone
4-aceto-3,5-dimethyl-2,6-dinitro-tert-butylbenzene
3,5-dinitro-4-tert-butyl-2,6-dimethylacetophenone
2,6-dimethyl-3,5-dinitro-4-tert-butyl acetophenone
SCHEMBL113330
mfcd00024271
1-[4-(tert-butyl)-2,6-dimethyl-3,5-dinitrophenyl]ethan-1-one
W-104216
CHEMBL1877463
4-t-butyl-2,6-dimethyl-3,5-dinitroacetophenone
2,6-dinitro-3,5-dimethyl-4-acetyl-tertbutylbenzene
WXCMHFPAUCOJIG-UHFFFAOYSA-N
4-tert-butyl-2,6-dimethyl-3,5-dinitroactophenone
1-acetyl-4-tert-butyl-2,6-dimethyl-3,5-dinitrobenzene
ketone musk
3,5-dinitro-2,6-dimethyl-4-tert-butyl acetophenone
1-[4-(1,1-dimethylethyl)-2,6-dimethyl-3,5-dinitrophenyl]ethanone
ketone moschus
1-(4-tert-butyl-2,6-dimethyl-3,5-dinitrophenyl)ethanone #
1-(4-tert-butyl-2,6-dimethyl-3,5-dinitrophenyl)ethan-1-one
SR-01000324027-1
sr-01000324027
musk ketone 10 microg/ml in cyclohexane
ketonmoschus
acetyl-dinitro-butyl-xylene
1-[4-(1,1-dimethylethyl)-2,6-dimethyl-3,5-dinitrophenyl]ethanone, 9ci
4'-tert-butyl-2', 6'-dimethyl-3',5'-dinitroacetophenone
4'-tert-butyl-2',6'-dimethyl-3',5'-dinitro-acetophenone
dinitro-tert-butylxylyl methyl ketone
musk ketone;3-methylcyclopentadecanone
3',5'-dinitro-2',6'-dimethyl-4'-tert-butylacetophenone
Q1948992
FS-4310
AC-34811
CS-0018535
HY-N2045

Research Excerpts

Overview

ExcerptReference
"Musk ketone is a widely used artificial fragrance which has been identified in human fatty tissue and milk. "( Freywald, C; Jenter, C; Knasmüller, S; Mersch-Sundermann, V; Parzefall, W; Schneider, H, 2001)

Drug Classes (1)

ClassDescription
aromatic ketoneA ketone in which the carbonyl group is attached to an aromatic ring.
[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]

Protein Targets (13)

Potency Measurements

ProteinTaxonomyMeasurementAverage (µ)Min (ref.)Avg (ref.)Max (ref.)Bioassay(s)
acetylcholinesteraseHomo sapiens (human)Potency79.64070.002541.796015,848.9004AID1347395
pregnane X receptorRattus norvegicus (Norway rat)Potency39.81070.025127.9203501.1870AID651751
AR proteinHomo sapiens (human)Potency0.00450.000221.22318,912.5098AID588515
estrogen receptor 2 (ER beta)Homo sapiens (human)Potency30.63790.000657.913322,387.1992AID1259378
nuclear receptor subfamily 1, group I, member 3Homo sapiens (human)Potency57.66580.001022.650876.6163AID1224838; AID1224839; AID1224893
retinoid X nuclear receptor alphaHomo sapiens (human)Potency22.25870.000817.505159.3239AID1159527; AID1159531; AID588544
farnesoid X nuclear receptorHomo sapiens (human)Potency39.81070.375827.485161.6524AID588526
pregnane X nuclear receptorHomo sapiens (human)Potency46.61310.005428.02631,258.9301AID1346982; AID720659
estrogen nuclear receptor alphaHomo sapiens (human)Potency30.63790.000229.305416,493.5996AID743080
thyroid stimulating hormone receptorHomo sapiens (human)Potency7.37400.001628.015177.1139AID1224843; AID1224895
nuclear factor of kappa light polypeptide gene enhancer in B-cells 1 (p105), isoform CRA_aHomo sapiens (human)Potency34.665419.739145.978464.9432AID1159509
v-jun sarcoma virus 17 oncogene homolog (avian)Homo sapiens (human)Potency43.64120.057821.109761.2679AID1159528
thyroid hormone receptor beta isoform 2Rattus norvegicus (Norway rat)Potency68.58960.000323.4451159.6830AID743065; AID743067
[prepared from compound, protein, and bioassay information from National Library of Medicine (NLM), extracted Dec-2023]

Research

Studies (79)

TimeframeStudies, This Drug (%)All Drugs %
pre-19904 (5.06)18.7374
1990's17 (21.52)18.2507
2000's22 (27.85)29.6817
2010's30 (37.97)24.3611
2020's6 (7.59)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 (1.23%)5.53%
Reviews5 (6.17%)6.00%
Case Studies1 (1.23%)4.05%
Observational0 (0.00%)0.25%
Other74 (91.36%)84.16%
[information is prepared from research data collected from National Library of Medicine (NLM), extracted Dec-2023]

Research Highlights

Safety/Toxicity (9)

ArticleYear
Synthetic musk in seafood products from south Europe using a quick, easy, cheap, effective, rugged and safe extraction method.
Food chemistry, Jun-01, Volume: 200
2016
Comparison of embryo toxicity using two classes of aquatic vertebrates.
Environmental toxicology and pharmacology, Volume: 37, Issue: 1
2014
Read-across estimates of aquatic toxicity for selected fragrances.
Alternatives to laboratory animals : ATLA, Volume: 41, Issue: 1
2013
[Toxic effect of musk ketone based on the determinations of wheat (Triticum aestivum) seed germination and root elongation].
Ying yong sheng tai xue bao = The journal of applied ecology, Volume: 19, Issue: 6
2008
Developmental toxicity studies of four fragrances in rats.
Toxicology letters, Dec-20, Volume: 111, Issue: 1-2
1999
Toxicity of nitromusks in early lifestages of South African clawed frog (Xenopus laevis) and zebrafish (Danio rerio).
Toxicology letters, Dec-20, Volume: 111, Issue: 1-2
1999
Genotoxicity of nitro musks in the micronucleus test with human lymphocytes in vitro and the human hepatoma cell line Hep G2.
Toxicology letters, Mar-14, Volume: 91, Issue: 1
1997
An evaluation of genotoxicity tests with Musk ketone.
Food and chemical toxicology : an international journal published for the British Industrial Biological Research Association, Volume: 34, Issue: 7
1996
A comparative study of five nitro musk compounds for genotoxicity in the SOS chromotest and Salmonella mutagenicity.
Toxicology letters, Volume: 85, Issue: 3
1996
[information is derived through text-mining from research data collected from National Library of Medicine (NLM), extracted Dec-2023]

Pharmacokinetics (2)

ArticleYear
Determination of polycyclic and nitro musks in environmental water samples by means of microextraction by packed sorbents coupled to large volume injection-gas chromatography-mass spectrometry analysis.
Analytica chimica acta, Apr-22, Volume: 773
2013
Stir-bar-sorptive extraction and liquid desorption combined with large-volume injection gas chromatography-mass spectrometry for ultra-trace analysis of musk compounds in environmental water matrices.
Analytical and bioanalytical chemistry, Volume: 396, Issue: 5
2010
[information is derived through text-mining from research data collected from National Library of Medicine (NLM), extracted Dec-2023]

Bioavailability (1)

ArticleYear
In vitro determination of transdermal permeation of synthetic musks and estimated dermal uptake through usage of personal care products.
Chemosphere, Volume: 173
2017
[information is derived through text-mining from research data collected from National Library of Medicine (NLM), extracted Dec-2023]

Dosage (7)

ArticleYear
Identification of bound nitro musk-protein adducts in fish liver by gas chromatography-mass spectrometry: biotransformation, dose-response and toxicokinetics of nitro musk metabolites protein adducts in trout liver as biomarkers of exposure.
Aquatic toxicology (Amsterdam, Netherlands), Jan-15, Volume: 106-107
2012
Biological transformation, kinetics and dose-response assessments of bound musk ketone hemoglobin adducts in rainbow trout as biomarkers of environmental exposure.
Journal of environmental sciences (China), Volume: 20, Issue: 7
2008
An in vivo mouse micronucleus assay on musk ketone.
Mutation research, Jan-24, Volume: 464, Issue: 2
2000
Developmental toxicity studies of four fragrances in rats.
Toxicology letters, Dec-20, Volume: 111, Issue: 1-2
1999
Effects of musk xylene and musk ketone on rat hepatic cytochrome P450 enzymes.
Toxicology letters, Dec-20, Volume: 111, Issue: 1-2
1999
Dermal absorption and disposition of musk ambrette, musk ketone and musk xylene in rats.
Toxicology letters, Dec-20, Volume: 111, Issue: 1-2
1999
Characterization of the effects of musk ketone on mouse hepatic cytochrome P450 enzymes.
Fundamental and applied toxicology : official journal of the Society of Toxicology, Volume: 40, Issue: 2
1997
[information is derived through text-mining from research data collected from National Library of Medicine (NLM), extracted Dec-2023]