| Substance | Relationship Strength | Studies | Trials | Classes | Roles |
|---|
2-butynedioic acid
2-butynedioic acid: RN given refers to parent cpd. butynedioic acid : An acetylenic compound that is acetylene in which the hydrogens are replaced by carboxy groups. | 2.15 | 1 | 0 | acetylenic compound;
C4-dicarboxylic acid | |
acetohydroxamic acid
acetohydroxamic acid: urease inhibitor. oxime : Compounds of structure R2C=NOH derived from condensation of aldehydes or ketones with hydroxylamine. Oximes from aldehydes may be called aldoximes; those from ketones may be called ketoximes.. N-hydroxyacetimidic acid : A carbohydroximic acid consisting of acetimidic acid having a hydroxy group attached to the imide nitrogen.. acetohydroxamic acid : A member of the class of acetohydroxamic acids that is acetamide in which one of the amino hydrogens has been replaced by a hydroxy group. | 2.15 | 1 | 0 | acetohydroxamic acids;
carbohydroximic acid | algal metabolite;
EC 3.5.1.5 (urease) inhibitor |
physostigmine
Physostigmine: A cholinesterase inhibitor that is rapidly absorbed through membranes. It can be applied topically to the conjunctiva. It also can cross the blood-brain barrier and is used when central nervous system effects are desired, as in the treatment of severe anticholinergic toxicity. | 2.1 | 1 | 0 | carbamate ester;
indole alkaloid | antidote to curare poisoning;
EC 3.1.1.8 (cholinesterase) inhibitor;
miotic |
chloroform
Chloroform: A commonly used laboratory solvent. It was previously used as an anesthetic, but was banned from use in the U.S. due to its suspected carcinogenicity.. chloroform : A one-carbon compound that is methane in which three of the hydrogens are replaced by chlorines. | 2.02 | 1 | 0 | chloromethanes;
one-carbon compound | carcinogenic agent;
central nervous system drug;
inhalation anaesthetic;
non-polar solvent;
refrigerant |
propiolic acid
propiolic acid: RN given refers to parent cpd; structure. propynoic acid : A terminal acetylenic compound that is a 3-carbon, straight-chain, monounsaturated fatty acid having one acetylenic bond. | 2.15 | 1 | 0 | acetylenic fatty acid;
alpha,beta-unsaturated monocarboxylic acid;
monounsaturated fatty acid;
short-chain fatty acid;
terminal acetylenic compound | xenobiotic metabolite |
acetylenedicarboxylic acid dimethyl ester
acetylenedicarboxylic acid dimethyl ester: inhibitor of oxidative phosphorylation | 2.15 | 1 | 0 | | |
cyclopentenone
2-cyclopenten-1-one : An enone that is cyclopentanone having a C=C double bond at position 2. | 2.15 | 1 | 0 | alicyclic ketone;
enone | Hsp70 inducer |
2-cyclohexen-1-one
2-cyclohexen-1-one: RN given refers to unlabeled cpd with specified locant for double bond. cyclohexenone : The parent compound of the cyclohexenones, composed of cyclohexanone having one double bond in the ring.. cyclohex-2-enone : A cyclohexenone having its C=C double bond at the 2-position. | 2.15 | 1 | 0 | cyclohexenone | |
iridium
Iridium: A metallic element with the atomic symbol Ir, atomic number 77, and atomic weight 192.22. | 2.1 | 1 | 0 | cobalt group element atom;
platinum group metal atom | |
phosphine
phosphane : The simplest phosphine, consisting of a single phosphorus atom with three hydrogens attached.. phosphine : Phosphane (PH3) and compounds derived from it by substituting one, two or three hydrogen atoms by hydrocarbyl groups: RPH2, R2PH, R3P (R =/= H) are called primary, secondary and tertiary phosphines, respectively. A specific phosphine is preferably named as a substituted phosphane. | 2.1 | 1 | 0 | mononuclear parent hydride;
phosphanes;
phosphine | carcinogenic agent;
fumigant insecticide |
fluorides
[no description available] | 2.11 | 1 | 0 | halide anion;
monoatomic fluorine | |
phenylpropiolic acid
phenylpropiolic acid: structure. phenylpropiolic acid : An acetylenic compound that is propynoic acid in which the acetylenic hydrogen is replaced by a phenyl group. | 2.15 | 1 | 0 | acetylenic compound;
alpha,beta-unsaturated monocarboxylic acid;
benzenes | |
ethyl 2-butynoate
[no description available] | 2.15 | 1 | 0 | | |
ethylphenylpropiolate
ethylphenylpropiolate: structure | 2.15 | 1 | 0 | | |
threitol
threitol: RN given refers to (R*,R*)-isomer. D-threitol : The D-enantiomer of threitol. | 2.04 | 1 | 0 | threitol | human metabolite |
2-oxindole
2-oxindole: RN given refers to parent cpd; structure. indolin-2-one : An indolinone carrying an oxo group at position 2. | 2.1 | 1 | 0 | gamma-lactam;
indolinone | |
esermethole
esermethole: structure in first source | 2.1 | 1 | 0 | | |
betadex
beta-Cyclodextrins: Cyclic GLUCANS consisting of seven (7) glucopyranose units linked by 1,4-glycosidic bonds. | 2.11 | 1 | 0 | cyclodextrin | |
aconitic acid
trans-aconitic acid : The trans-isomer of aconitic acid. | 2.15 | 1 | 0 | aconitic acid | fundamental metabolite |
maleic acid
maleic acid: RN given refers to parent cpd(Z)-isomer which is maleic acid; all RR's given refer to (Z)-isomer; (E)-isomer is fumaric acid. maleic acid : A butenedioic acid in which the double bond has cis- (Z)-configuration. | 2.15 | 1 | 0 | butenedioic acid | algal metabolite;
mouse metabolite;
plant metabolite |
e-z cinnamic acid
cinnamic acid : A monocarboxylic acid that consists of acrylic acid bearing a phenyl substituent at the 3-position. It is found in Cinnamomum cassia.. trans-cinnamic acid : The E (trans) isomer of cinnamic acid | 2.15 | 1 | 0 | cinnamic acid | plant metabolite |
fumaric acid
fumaric acid: see also record for ferrous fumarate; use FUMARATES for general fumaric acid esters. fumaric acid : A butenedioic acid in which the C=C double bond has E geometry. It is an intermediate metabolite in the citric acid cycle. | 2.15 | 1 | 0 | butenedioic acid | food acidity regulator;
fundamental metabolite;
geroprotector |
calix(4)arene
calix(4)arene: a cyclophane consisting of four phenolic units linked by methylene groups; structure in first source | 2.11 | 1 | 0 | | |
dimethyl fumarate
[no description available] | 2.15 | 1 | 0 | diester;
enoate ester;
methyl ester | antipsoriatic;
immunomodulator |
ethyl cinnamate
ethyl cinnamate: a pine weevil antifeedant; structure in first source | 2.15 | 1 | 0 | alkyl cinnamate;
ethyl ester | |
diethyl fumarate
diethyl fumarate : A dieter obtained by the formal condensation of fumaric acid with ethanol. | 2.15 | 1 | 0 | diester | metabolite |
3-(4-methylbenzoyl)acrylic acid
[no description available] | 2.15 | 1 | 0 | carbonyl compound | |
calixarenes
Calixarenes: Phenolic metacyclophanes derived from condensation of PHENOLS and ALDEHYDES. The name derives from the vase-like molecular structures. A bracketed [n] indicates the number of aromatic rings.. calixarenes : Originally macrocyclic compounds capable of assuming a basket (or "calix") shaped conformation. They are formed from p-hydrocarbyl phenols and formaldehyde. The term now applies to a variety of derivatives by substitution of the hydrocarbon cyclo{oligo[(1,3-phenylene)methylene]}.. calixarene : A macrocycle composed of 1,3-phenylene groups linked by methylene groups. The number of 1,3-phenylene units in the macrocycle is denoted by the "n" in calix[n]arene name. | 2.11 | 1 | 0 | | |
dimethyl maleate
dimethyl maleate: structure. dimethyl maleate : A maleate ester resulting from the formal condensation of both carboxy groups of maleic acid with methanol. It is commonly used as a dienophile for Diels-Alder-type cycloaddition reactions in organic synthesis. | 2.15 | 1 | 0 | diester;
maleate ester;
methyl ester | |
ethyl fumarate
[no description available] | 2.15 | 1 | 0 | | |
chitosan
[no description available] | 2.11 | 1 | 0 | | |