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It is a member of atomic nucleus, a monoatomic hydrogen, a monoatomic monocation and a monovalent inorganic cation. | Hydron is the general name for the hydrogen nucleus, to be used without regard to the hydrogen nuclear mass (either for hydrogen in its natural abundance or where it is not desired to distinguish between the isotopes). | 0 |
It is a tryptophan derivative, a non-proteinogenic alpha-amino acid and an organochlorine compound. | 6-chlorotryptophan is a tryptophan derivative that is tryptophan in which the hydrogen at position 6 of the indole ring has been replaced by a chlorine. | 0 |
It is functionally related to a dTDP-L-mannose. | DTDP-4-dehydro-6-deoxy-L-mannose is a dTDP-sugar having 4-dehydro-6-deoxy-L-mannose as the sugar portion. | 0 |
It is a conjugate base of a kynuramine(1+). | It has a role as a metabolite. | 0 |
Methyl 2,5-dichlorobenzoate is a methyl ester resulting from the formal condensation of the carboxy group of 2,5-dichlorobenzoic acid with methanol. | It is functionally related to a 2,5-dichlorobenzoic acid. | 0 |
It is functionally related to a D-glucuronic acid. | D-glucurono-6,2-lactone is a glucuronolactone. | 0 |
Calcium stearate is an organic calcium salt of stearic acid. | It contains an octadecanoate. | 0 |
It is a conjugate acid of a tetrafluoroborate(1-). | Tetrafluoroboric acid is a boron fluoride. | 0 |
3-oxoalanine is a non-proteinogenic alpha-amino acid that is serine in which the alcoholic hydroxy group has been formally oxidised to the corresponding formyl group. | It is a non-proteinogenic alpha-amino acid and an alanine derivative. | 0 |
It is functionally related to a 4-nitrophenol. | Boc-Asn-OPhNO2 is a L-asparagine derivative, a primary carboxamide, a carbamate ester and a C-nitro compound. | 0 |
3,5-dinitrosalicylic acid is a monohydroxybenzoic acid consisting of 2-hydroxybenzoic acid having nitro substituents at the 3- and 5-positions. | It is a C-nitro compound and a monohydroxybenzoic acid. | 0 |
It is a conjugate base of a blasticidin S(1+). | Blasticidin S is a blasticidin that is an antibiotic obtained from Streptomyces griseochromogene. | 0 |
It has a role as a bacterial metabolite. | 12-aminododecanoic acid is an omega-amino fatty acid that is dodecanoic acid in which one of the terminal amino hydrogens has been replaced by an amino group. | 0 |
Gallamine is a tertiary amine non-depolarising muscle relaxant whose structure comprises a core benzene molecule substituted at each of C-1, C-2 and C-3 by an N,N-diethyl-2-(ethylamino)ethoxy group. | It has a role as a muscle relaxant, a cholinergic antagonist and a drug allergen. | 0 |
It is a monoalkyl phosphate and an aminopyrimidine. | 4-amino-2-methyl-5-phosphooxymethylpyrimidine is an aminopyrimidine having the amino group at the 4-position together with methyl and phosphooxymethyl groups at the 2- and 5-positions respectively. | 0 |
It is a conjugate acid of an ethylmercurithiosalicylate. | Ethylmercurithiosalicylic acid is an alkylmercury compound. | 0 |
Anolignan A is a lignan that consists of buta-1,3-diene substituted by a 2,4-dihydroxybenzyl group at position 2 and a 1,3-benzodioxol-5-ylmethyl group at position 3. | It is a lignan, a member of benzodioxoles and a member of resorcinols. | 0 |
3,5-xylenol is a member of the class of phenols that phenol substituted by methyl groups at positions 3 and 5. | It derives from a hydride of a m-xylene. | 0 |
It has a role as an analgesic, a NMDA receptor antagonist and an intravenous anaesthetic. | It is an enantiomer of a (R)-ketamine. | 0 |
It is functionally related to a benzyl alcohol. | It has a role as a Camellia sinensis metabolite. | 0 |
It is a conjugate acid of a 7-hydroxy-8-[(naphthalen-1-yl)diazenyl]naphthalene-1,3-disulfonate. | 7-hydroxy-8-[(naphthalen-1-yl)diazenyl]naphthalene-1,3-disulfonic acid is a naphthalenesulfonic acid that is naphthalene-1,3-disulfonic acid carrying additional hydroxy and (naphthalen-1-yl)diazenylsubstituents at positions 7 and 8 respectively. | 0 |
Methyl uridin-5-yloxyacetate is a methyl ester that is uridine which is substituted at position 5 on the uracil ring by a methoxycarbonylmethoxy group. | It is a member of uridines and a methyl ester. | 0 |
It is a 17-oxo steroid, a 3beta-hydroxy-Delta(5)-steroid, an androstanoid and a 7-oxo steroid. | 7-ketodehydroepiandrosterone is a 3beta-hydroxy-Delta(5)-steroid that is dehydroepiandrosterone carrying an additional oxo group at position 7. | 0 |
It has a role as a persistent organic pollutant. | Beta-hexachlorocyclohexane is the beta-isomer of hexachlorocyclohexane. | 0 |
It is a quinolone antibiotic, a fluoroquinolone antibiotic, a member of cyclopropanes, a N-arylpiperazine, a quinolone, an aminoquinoline and a quinolinemonocarboxylic acid. | It has a role as an antiinfective agent, a topoisomerase IV inhibitor, an antibacterial drug, an EC 5.99.1.3 [DNA topoisomerase (ATP-hydrolysing)] inhibitor, a DNA synthesis inhibitor, an antimicrobial agent, an environmental contaminant and a xenobiotic. | 0 |
Bruceolide is a quassinoid isolated from Brucea javanica and Brucea sumatrana and has been shown to exhibit antimalarial activity. | It has a role as a metabolite, an antimalarial and an antineoplastic agent. | 0 |
Anthracene blue SWR is a hexahydroxyanthraquinone that is anthracene-9,10-dione in which the six hydroxy substituents are located at positions 1, 2, 4, 5, 6 and 8. | Used as as a hematoxylin substitute in H&E staining. | 0 |
It has a role as an antineoplastic agent, an antioxidant, an apoptosis inducer and a metabolite. | It is a conjugate acid of a peonidin(1-). | 0 |
It is functionally related to a 6-aminohexanoic acid. | N-(2,4-dinitrophenyl)aminohexanoic acid is a C-nitro compound comprising hexanoic acid with a (2,4-dinitrophenyl)amino substituent at position C-6. | 0 |
Zidovudine is a pyrimidine 2',3'-dideoxyribonucleoside compound having a 3'-azido substituent and thymine as the nucleobase. | It has a role as an antiviral drug, an antimetabolite and a HIV-1 reverse transcriptase inhibitor. | 0 |
It is an enantiomer of a L-glyceric acid. | D-glyceric acid is the D-enantiomer of glyceric acid. | 0 |
Tetraphenylarsonium is an arsonium ion consisting of four phenyl groups attached to a central arsonium. | It derives from a hydride of an arsonium. | 0 |
It is an alkaloid found in tobacco plants and exhibits genotoxic effects. | It has a role as a plant metabolite, an EC 1.14.14.14 (aromatase) inhibitor and a mutagen. | 0 |
It is functionally related to a 2-furoic acid. | Ethyl 3-furoate is a carboxylic ester. | 0 |
It is functionally related to an acetic acid. | It is a monocarboxylic acid and a member of monochlorobenzenes. | 0 |
It has a role as a melanin synthesis inhibitor, a dermatologic drug and an allergen. | It is used as a topical drug for medical depigmentation. | 0 |
5-hydroxybenzofuran-2-one is a member of the class of 1-benzofurans that is 1-benzofuran-2(3H)-one substituted by a hydroxy group at position 5. | It has a role as an antifungal agent and a fungal metabolite. | 0 |
An antineoplastic chemotherapy drug used for treatment of Hodgkin's lymphoma. | It is a conjugate base of a procarbazine(1+). | 0 |
2,3,4-trichlorobiphenyl is a trichlorobiphenyl that is biphenyl in which the hydrogens at positions 2, 3, and 4 on one of the benzene rings are replaced by chlorines. | It is a trichlorobiphenyl and a trichlorobenzene. | 0 |
It is a cyclitol, an alicyclic ketone and a tertiary alcohol. | Valiolone is a cyclitol that is cyclohexanone which is substituted by hydroxy groups at positions 2, 3, 4, and 5, and by a hydroxymethyl group at position 5 (the 2R,3S,4S,5S stereoisomer). | 0 |
It contains a xylazine(1+). | It has a role as an alpha-adrenergic agonist, an analgesic, an emetic, a muscle relaxant and a sedative. | 0 |
2-ethoxy-3,3-dimethyl-2,3-dihydro-1-benzofuran-5-yl methanesulfonate is a methanesulfonate ester that is methanesulfonic acid in which the hydrogen of the hydroxy group has been replaced by a 2-ethoxy-3,3-dimethyl-2,3-dihydro-1-benzofuran-5-yl group. | It is an ether, a methanesulfonate ester and a member of 1-benzofurans. | 0 |
It is functionally related to a propan-1-ol. | It has a role as a fragrance and a plant metabolite. | 0 |
It has a role as an antiparasitic agent and a drug allergen. | A folic acid antagonist, it is used as a synergist with sulfonamides against the parasitic Eimeria species. | 0 |
1-cyclopentylethanol is a secondary alcohol that is ethanol in which one of the hydrogens at position 1 has been replaced by a cyclopentyl group. | It is a member of cyclopentanes and a secondary alcohol. | 0 |
Hexyl butyrate is a fatty acid ester obtained by the formal condensation of hexanol with butyric acid. | It has a role as an animal metabolite. | 0 |
PD-146176 is an organic heterotetracyclic compound that is 1H-indole which is ortho-fused to a 2H-1-benzothiopyran group at positions 2-3. | It has a role as a ferroptosis inhibitor, an EC 1.13.11.33 (arachidonate 15-lipoxygenase) inhibitor and an antiatherogenic agent. | 0 |
It has a role as a metabolite. | It is functionally related to an orlandin. | 0 |
(-)-isodihydrocarveol is the (1R,2R,4S)-stereoisomer of dihydrocarveol. | It is an enantiomer of a (+)-isodihydrocarveol. | 0 |
It is a potent molluscicide and the active ingredient in most slug pellets used for crop protection. | Metaldehyde is a member of the class of tetroxocanes that is 1,3,5,7-tetroxocane which carries four methyl groups at positions 2,4,6 and 8. | 0 |
N(6)-butyryl-cAMP is a 3',5'-cyclic purine nucleotide that is 3',5'-cyclic AMP in which the exocyclic amino group on the purine fragment is carrying a butyryl substituent. | It has a role as a protein kinase agonist. | 0 |
It is a member of indoles and a hydroxy monocarboxylic acid. | Leucodopachrome is indoline substituted with hydroxy groups at C-5 and -6 and a carboxy group at C-2, and with S stereochemistry at C-2. | 0 |
In the solid state it exists as a glass, with four-coordinate Be(2+) tetrahedral centres and two-coordinate fluoride centres. | In protein crystallography it is used as a mimic of phosphate. | 0 |
A fungicide used to control a wide range of diseases including grey mould on strawberries, tomatoes and cucumabers, and scab on apples and pears. | It has a role as an aryl hydrocarbon receptor agonist, a hepatotoxic agent and an antifungal agrochemical. | 0 |
It is a conjugate acid of a ferrozine(2-). | Ferrozine free acid is an arenesulfonic acid that is the 4,4'-disulfo derivative of 5,6-diphenyl-3-(pyridin-2-yl)-1,2,4-triazine. | 0 |
It is an enantiomer of a 2-deoxy-5-O-phosphono-beta-L-ribofuranosylcytosine. | 2'-deoxycytosine 5'-monophosphate is a pyrimidine 2'-deoxyribonucleoside 5'-monophosphate having cytosine as the nucleobase. | 0 |
It contains a cyclopentolate. | It is used to produce mydriasis (excessive dilation of the pupil) and cycloplegia (paralysis of the ciliary muscle of the eye) for opthalmic diagnostic procedures. | 0 |
It has a role as a metabolite. | It is a conjugate acid of a (5S)-5-(carboxymethyl)-L-proline(1-). | 0 |
7,8-dichloro-1,2,3,4-tetrahydroisoquinoline is a 1,2,3,4-tetrahydroisoquinoline hacing chloro substituents at the 7- and 8-positions. | It is a member of isoquinolines and an organochlorine compound. | 0 |
Cocaine is a tropane alkaloid obtained from leaves of the South American shrub Erythroxylon coca. | It is a conjugate base of a cocaine(1+). | 0 |
6-decylubiquinone is a member of the class of 1,4-benzoquinones that is 2,3-dimethoxybenzoquinone which has been substituted at positions 5 and 6 by decyl and methyl groups. | It has a role as a cofactor. | 0 |
It is functionally related to a phosphonic acid. | It is a member of benzenes, a member of phosphonic acids and a primary amino compound. | 0 |
Quercetin 5,7,3',4'-tetramethyl ether is a tetramethoxyflavone that is the 5,7,3',4'-tetramethy-derivative of quercetin. | It has a role as a plant metabolite. | 0 |
Betavulgarin is a hydroxyisoflavone that is isoflavone substituted by a hydroxy group at position 2', a methoxy group at position 5 and a methylenedioxy group across positions 6 and 7 respectively. | It has a role as a plant metabolite. | 0 |
It is a conjugate acid of a glycocholate. | It is functionally related to a cholic acid and a glycochenodeoxycholic acid. | 0 |
It has a role as a marine xenobiotic metabolite. | N(4)-acetylsulfamethazine is a sulfonamide that is benzenesulfonamide substituted by an acetylamino group at position 4 and a 4,6-dimethyl-pyrimidin-2-yl group at the nitrogen atom. | 0 |
It is an acetate ester and a non-proteinogenic alpha-amino acid. | It is a tautomer of an O-acetylhomoserine zwitterion. | 0 |
It is a member of maleimides and a N-hydroxysuccinimide ester. | Succinimidyl 4-(N-maleimidomethyl)cyclohexane-1-carboxylate is an N-hydroxysuccinimide ester derived from 4-(N-maleimidomethyl)cyclohexane-1-carboxylic acid. | 0 |
2,3-dihydro-2-(4-hydroxyphenyl)-5,6,7-trimethoxy-4H-1-benzopyran-4-one is a methoxyflavanone that is flavanone substituted by methoxy groups at positions 5, 6 and 7 and a hydroxy group at position 4'. | It is a methoxyflavanone, a monohydroxyflavanone and a member of 4'-hydroxyflavanones. | 0 |
It has a role as a non-steroidal anti-inflammatory drug, a cyclooxygenase 2 inhibitor, a non-narcotic analgesic, an antirheumatic drug and an antipyretic. | It is a member of isoxazoles and a sulfonamide. | 0 |
Distigmine bromide is an organic bromide salt of distigmine. | It contains a distigmine. | 0 |
It contains a succinylcholine. | It has a role as a muscle relaxant. | 0 |
It is a beta-amino acid and a diamino acid. | (3S,5S)-3,5-diaminohexanoic acid is a chiral diamino acid consisting of hexanoic acid having amino substituents at the 3- and 5-positions and (S,S)-configuration. | 0 |
3-tert-butyl-4-hydroxyanisole is an aromatic ether that is 4-methoxyphenol in which one of the hydrogens ortho- to the phenolic hydroxy group is replaced by a tert-butyl group. | It has a role as an antioxidant and a human xenobiotic metabolite. | 0 |
It is a penicillin and a quinoxaline derivative. | It has a role as an antibacterial drug. | 0 |
It is an enantiomer of a (S)-(-)-verbenone. | It has a role as a plant metabolite. | 0 |
Tetradecamethylcycloheptasiloxane is a macrocyclic organosiloxane composed from seven units of dimethylsiloxane. | It has a role as a marine xenobiotic metabolite. | 0 |
It has a role as an intercalator. | It contains a N-(2-chloroethyl)-N'-(6-chloro-2-methoxyacridin-9-yl)-N-ethylpropane-1,3-diamine. | 0 |
3-methylcatechol is a methylcatechol carrying a methyl substituent at position 3. | It is a xenobiotic metabolite produced by some bacteria capable of degrading nitroaromatic compounds present in pesticide-contaminated soil samples. | 0 |
It is a member of azobenzenes, a bis(azo) compound and a member of perimidines. | A fat-soluble dye predominantly used for demonstrating triglycerides in frozen sections and for staining of protein bound lipids in paraffin sections. | 0 |
It is an aluminium cation, a monoatomic trication and a monoatomic aluminium. | Aluminium(3+) is an aluminium cation that has a charge of +3. | 0 |
It is functionally related to a D-threose. | D-threose 4-phosphate is a threose phosphate. | 0 |
L-glutamic 5-semialdehyde is a glutamic semialdehyde arising from formal reduction of the side-chain carboxy group of L-glutamic acid. | It is a tautomer of a L-glutamic 5-semialdehyde zwitterion. | 0 |
Terazosin is a member of quinazolines, a member of piperazines, a member of furans and a primary amino compound. | It has a role as an antineoplastic agent, an antihypertensive agent and an alpha-adrenergic antagonist. | 0 |
Phenylhydrazine is a phenylhydrazine that is the monophenyl derivative of hydrazine. | It has a role as a xenobiotic. | 0 |
It is functionally related to an octadecanoic acid. | 2-stearoylglycerol is a 2-monoglyceride where the acyl group is octadecanoyl (stearoyl). | 0 |
Beta-naphthoflavone is an extended flavonoid resulting from the formal fusion of a benzene ring with the f side of flavone. | It has a role as an aryl hydrocarbon receptor agonist. | 0 |
It has a role as a mordant, a catalyst and an astringent. | It contains an iron(3+) sulfate. | 0 |
It has a role as a fragrance, a Saccharomyces cerevisiae metabolite, a plant metabolite, an Aspergillus metabolite and a plant growth retardant. | 2-phenylethanol is a primary alcohol that is ethanol substituted by a phenyl group at position 2. | 0 |
1,3-diphenylurea is a member of the class of phenylureas that is urea in which one of the hydrogens of each amino group is replaced by a phenyl group. | It is present in coconut milk (Cocos nucifera). | 0 |
Amcinonide is a corticosteroid, an 11beta-hydroxy steroid, a fluorinated steroid, a 20-oxo steroid, an acetate ester, a spiroketal and a 3-oxo-Delta(1),Delta(4)-steroid. | It derives from a hydride of a pregnane. | 0 |
It is an enantiomer of a (3R,4S)-3,4-dihydrophenanthrene-3,4-diol. | (3S,4R)-3,4-dihydrophenanthrene-3,4-diol is a cis-3,4-dihydrophenanthrene-3,4-diol. | 0 |
It has a role as a plant metabolite. | 10-undecenoate is an undecenoate that is the conjugate base of 10-undecenoic acid. | 0 |
It is functionally related to a dehydroepiandrosterone. | Dehydroepiandrosterone sulfate is a steroid sulfate that is the 3-sulfooxy derivative of dehydroepiandrosterone. | 0 |
It is an anthracycline antibiotic, an aminoglycoside antibiotic, a member of tetracenequinones, a member of p-quinones and a tertiary alpha-hydroxy ketone. | It derives from a hydride of a tetracene. | 0 |
4 is a C-nitro compound. | HC Yellow No. | 0 |
It has a role as a plant metabolite. | It has been isolated from the roots of Rubia yunnanensis. | 0 |
It is an enantiomer of a (-)-ureidoglycolic acid. | (+)-ureidoglycolic acid is a ureidoglycolic acid. | 0 |
It has a role as an antidiarrhoeal drug. | In an attempt to discourage abuse (at high doses, difenoxin acts like morphine), preparations usually contain subclinical amounts of atropine sulfate. | 0 |
It is functionally related to a p-toluidine. | 2-nitro-p-toluidine is a C-nitro compound in which the nitro compound is ortho to the amino group and meta to the methyl group of p-toluidine. | 0 |