IDEA-AI4S/PubChemSFT huggingface dataset:
Molecule SMILES: COc1c(O)ccc2c1OCC1c3cc4c(cc3OC21)OCO4

system: You are a chemist. Now you are given a representation of a molecule. Please help me to understand the molecule.

user: Could you give me a brief overview of this molecule <molecule_2d> ?

assistant: 4-Methoxymaackiain is a natural product found in Ulex airensis, Bobgunnia madagascariensis, and other organisms with data available.
Molecule SMILES: C=C1CCC2(C)CCC3(C)C4C(O)C(OC(C)=O)C5(C(C)O)COC(=O)C=CC5C4(C)CCC3(C(=O)OC)C2(O)C1

system: You are a chemist. Now you are given a representation of a molecule. Please help me to understand the molecule.

user: Tell me something about this molecule: <molecule_2d>

assistant: galphimine G is a natural product found in Galphimia glauca with data available.
Molecule SMILES: CC=Cc1cnc2c(c1)C(=O)N(C(C)CO)CC(C)C(CN(C)C(=O)c1cnccn1)O2

system: You are a chemist. Now you are given a representation of a molecule. Please help me to understand the molecule.

user: <molecule_2d> What do you know about the molecule?

assistant: LSM-25340 is a member of pyrazines and a tertiary carboxamide.
Molecule SMILES: C=C1COC(=O)C12CC1(C)C(C)CCCC1C2O

system: You are a chemist. Now you are given a representation of a molecule. Please help me to understand the molecule.

user: Could you give me a brief overview of this molecule <molecule_2d> ?

assistant: Bakkenolide S is a natural product found in Petasites formosanus with data available.
Molecule SMILES: CC(C)=CC(=O)C=C(C)CCCC1(C)Oc2oc3cc(O)ccc3c(=O)c2C1C

system: You are a chemist. Now you are given a representation of a molecule. Please help me to understand the molecule.

user: <molecule_2d> What do you know about the molecule?

assistant: Fukanefurochromone D is a natural product found in Ferula fukanensis with data available.
Molecule SMILES: CC(C)=CCC(O)C1(C)CCCC2(C=O)C(C=O)=C(C)CCC21

system: You are a chemist. Now you are given a representation of a molecule. Please help me to understand the molecule.

user: Given the molecule <molecule_2d>, what can you tell me about it?

assistant: (4aS,5R,8aR)-5-[(1S)-1-hydroxy-4-methylpent-3-enyl]-2,5-dimethyl-3,4,4a,6,7,8-hexahydronaphthalene-1,8a-dicarbaldehyde is a natural product found in Porella platyphylla with data available.
Molecule SMILES: COC(C(C)O)C(C)C1OC1(C)CC(C)C=CC=C(C)C1OC(CC(=O)O)CCC1C

system: You are a chemist. Now you are given a representation of a molecule. Please help me to understand the molecule.

user: Provide a description of this molecule <molecule_2d> .

assistant: Herboxidiene is a natural product found in Streptomyces chromofuscus with data available.
Molecule SMILES: C=C(C)C1CCC2(COC(=O)C=Cc3ccc(O)c(O)c3)CCC3(C(=O)O)C(CCC4C5(C)CCC(O)C(C)(C)C5CCC43C)C12

system: You are a chemist. Now you are given a representation of a molecule. Please help me to understand the molecule.

user: <molecule_2d> What do you know about the molecule?

assistant: 3beta-Hydroxy-28-[(3,4-dihydroxy-trans-cinnamoyl)oxy]lup-20(29)-en-27-oic acid is a natural product found in Rhoiptelea chiliantha with data available.
Molecule SMILES: C=C1C(=O)OC2C3C(COC(=O)C(=O)O)=CC(=O)C3=C(C)CC(O)C12

system: You are a chemist. Now you are given a representation of a molecule. Please help me to understand the molecule.

user: Describe this molecule: <molecule_2d> .

assistant: 2-[(4-hydroxy-6-methyl-3-methylidene-2,7-dioxo-4,5,9a,9b-tetrahydro-3aH-azuleno[8,7-b]furan-9-yl)methoxy]-2-oxoacetic acid is a natural product found in Lactuca sativa with data available.
Molecule SMILES: CC1OC(OC2C(CO)OC(OC3CCC45CC46CCC4(C)C(C7(C)CCC(C(C)(C)O)O7)C(O)CC4(C)C6CC(O)C5C3(C)C)C(O)C2O)C(O)C(O)C1O

system: You are a chemist. Now you are given a representation of a molecule. Please help me to understand the molecule.

user: <molecule_2d> What do you know about the molecule?

assistant: Astraverrucin IV is a natural product found in Astragalus verrucosus and Astragalus kahiricus with data available.
Molecule SMILES: COc1ccc2c3c(n(C)c2c1)C(CO)N(Cc1nccs1)CC31CCN(CC2CCCC2)CC1

system: You are a chemist. Now you are given a representation of a molecule. Please help me to understand the molecule.

user: Tell me something about this molecule: <molecule_2d>

assistant: [(1R)-1'-(cyclopentylmethyl)-7-methoxy-9-methyl-2-(2-thiazolylmethyl)-1-spiro[1,3-dihydropyrido[3,4-b]indole-4,4'-piperidine]yl]methanol is a harmala alkaloid.
Molecule SMILES: Cc1cc(O)cc(O)c1C(=O)c1c(O)cc(O)cc1Cc1cc(O)c(Cc2c(O)cc(Cc3cc(O)cc(O)c3C(=O)c3c(C)cc(O)cc3O)oc2=O)c(=O)o1

system: You are a chemist. Now you are given a representation of a molecule. Please help me to understand the molecule.

user: Please give me some details about this molecule <molecule_2d> .

assistant: Strepolyketide B is a natural product found in Streptomyces with data available.
Molecule SMILES: CC=C(C)C(=O)OC1CCN2CCC(CO)C12

system: You are a chemist. Now you are given a representation of a molecule. Please help me to understand the molecule.

user: Tell me something about this molecule: <molecule_2d>

assistant: 7-Angeloylplatynecine is a natural product found in Senecio serra, Delairea odorata, and Senecio chrysocoma with data available.
Molecule SMILES: CC1=CC2C3C(CC(=O)C24C(=O)NC(Cc2ccccc2)C4C1C)C1CC(CO)CC3(C)O1

system: You are a chemist. Now you are given a representation of a molecule. Please help me to understand the molecule.

user: <molecule_2d> The above is a compound. Could you please tell me something about it?

assistant: Xylastriasan A is a natural product found in Xylaria striata with data available.
Molecule SMILES: Cc1c(O)cc2ccc3c(C)c(O)cc4ccc1c2c43

system: You are a chemist. Now you are given a representation of a molecule. Please help me to understand the molecule.

user: Could you provide a description of this molecule <molecule_2d> ?

assistant: 1,6-Dimethylpyrene-2,7-diol is a natural product found in Juncus acutus with data available.
Molecule SMILES: CCC=CCC=CCC1(O)C(=CC(OC(C)=O)C(CCCC(=O)OC)OC(C)=O)C(=O)C2(Cl)OC12

system: You are a chemist. Now you are given a representation of a molecule. Please help me to understand the molecule.

user: Describe this molecule: <molecule_2d> .

assistant: 10S,11R-epoxy-punaglandin 3 is a clavulone.
Molecule SMILES: COc1ccc2c(c1OC)C(=O)N1CCc3cc4c(cc3C1C2(O)OC1c2c(ccc(OC)c2OC)C(O)C2(O)c3cc5c(cc3CCN12)OCO5)OCO4

system: You are a chemist. Now you are given a representation of a molecule. Please help me to understand the molecule.

user: Please give me some details about this molecule <molecule_2d> .

assistant: (1R,21R)-21-[[(1R,14S,21R)-1,21-dihydroxy-16,17-dimethoxy-5,7-dioxa-13-azapentacyclo[11.8.0.02,10.04,8.015,20]henicosa-2,4(8),9,15(20),16,18-hexaen-14-yl]oxy]-21-hydroxy-16,17-dimethoxy-5,7-dioxa-13-azapentacyclo[11.8.0.02,10.04,8.015,20]henicosa-2,4(8),9,15(20),16,18-hexaen-14-one is a natural product found in Berberis heteropoda with data available.
Molecule SMILES: CC(=O)OC1(C)C(=O)C2=C(CC3(CCCC(C)O3)OC2)C(=C2C(=O)C(C)(OC(C)=O)C(=O)C3=C2CC2(CCCC(C)O2)OC3)C1=O

system: You are a chemist. Now you are given a representation of a molecule. Please help me to understand the molecule.

user: Could you provide a description of this molecule <molecule_2d> ?

assistant: Thielavialide E is a natural product found in Thielavia with data available.
Molecule SMILES: O=C(CC1C=CC(NC(=O)CN2CCOCC2)C(CO)O1)NC1CCCCC1

system: You are a chemist. Now you are given a representation of a molecule. Please help me to understand the molecule.

user: Please give me some details about this molecule <molecule_2d> .

assistant: N-cyclohexyl-2-[(2R,3R,6R)-2-(hydroxymethyl)-3-[[2-(4-morpholinyl)-1-oxoethyl]amino]-3,6-dihydro-2H-pyran-6-yl]acetamide is an amino acid amide.
Molecule SMILES: COc1ccccc1C#Cc1ccc2c(c1)OC(CN(C)Cc1ccccc1)C(C)CN(C(C)CO)S2(=O)=O

system: You are a chemist. Now you are given a representation of a molecule. Please help me to understand the molecule.

user: <molecule_2d> The above is a compound. Could you please tell me something about it?

assistant: (2R)-2-[(4S,5R)-8-[2-(2-methoxyphenyl)ethynyl]-4-methyl-5-[[methyl-(phenylmethyl)amino]methyl]-1,1-dioxo-4,5-dihydro-3H-6,1$l^{6},2-benzoxathiazocin-2-yl]-1-propanol is an aromatic amine.
Molecule SMILES: C=C(C)C1CCC(C)C2(O)C1C=C(C)C(OC(C)=O)C2OC(=O)C(CC(=O)c1ccccc1NC)NC=O

system: You are a chemist. Now you are given a representation of a molecule. Please help me to understand the molecule.

user: Could you provide a description of this molecule <molecule_2d> ?

assistant: Eurochevalierine is a natural product found in Aspergillus chevalieri with data available.
Molecule SMILES: CC(O)=NC(C)(C)C(=O)N1CCCC1C(O)=NC(C)(C)C(O)=NC(C)C(O)=NC(C)(C)C(O)=NC(C)C(O)=NC(CCC(=N)O)C(O)=NC(C)(C)C(O)=NC(C(O)=NC(C)(C)C(O)=NCC(O)=NC(CC(C)C)C(O)=NC(C)(C)C(=O)N1CCCC1C(O)=NC(C(O)=NC(C)(C)C(O)=NC(C)(C)C(O)=NC(CCC(=N)O)C(O)=NC(CCC(=N)O)C(O)=NC(CNCCO)Cc1ccccc1)C(C)C)C(C)C

system: You are a chemist. Now you are given a representation of a molecule. Please help me to understand the molecule.

user: Provide a description of this molecule <molecule_2d> .

assistant: septocylindrin B is a natural product found in Septocylindrium with data available.
Molecule SMILES: CC(C)=CCCC(C)(OC1OC(COC2OC(CO)C(O)C2O)C(O)C(O)C1O)C1CCC2(C)C1C(O)CC1C3(C)CCC(OC4OC(CO)C(O)C(O)C4OC4OC(CO)C(O)C(O)C4O)C(C)(C)C3CCC12C

system: You are a chemist. Now you are given a representation of a molecule. Please help me to understand the molecule.

user: Describe this molecule: <molecule_2d> .

assistant: 2-[[2-[[17-[2-[[6-[[3,4-dihydroxy-5-(hydroxymethyl)-2-oxolanyl]oxymethyl]-3,4,5-trihydroxy-2-oxanyl]oxy]-6-methylhept-5-en-2-yl]-12-hydroxy-4,4,8,10,14-pentamethyl-2,3,5,6,7,9,11,12,13,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl]oxy]-4,5-dihydroxy-6-(hydroxymethyl)-3-oxanyl]oxy]-6-(hydroxymethyl)oxane-3,4,5-triol is a steroid saponin.
Molecule SMILES: CC(C)=CCCC(C)(OC1OC(COC2OC(CO)C(O)C2O)C(O)C(O)C1O)C1CCC2(C)C1C(O)CC1C3(C)CCC(OC4OC(CO)C(O)C(O)C4OC4OC(CO)C(O)C(O)C4O)C(C)(C)C3CCC12C

system: You are a chemist. Now you are given a representation of a molecule. Please help me to understand the molecule.

user: Could you provide a description of this molecule <molecule_2d> ?

assistant: 2-[2-[[17-[2-[6-[[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]oxymethyl]-3,4,5-trihydroxyoxan-2-yl]oxy-6-methylhept-5-en-2-yl]-12-hydroxy-4,4,8,10,14-pentamethyl-2,3,5,6,7,9,11,12,13,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl]oxy]-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl]oxy-6-(hydroxymethyl)oxane-3,4,5-triol is a natural product found in Panax ginseng and Panax quinquefolius with data available.
Molecule SMILES: COCC(=O)N1CC(C)C(OC)CN(C)C(=O)c2ccc(NS(C)(=O)=O)cc2OCC1C

system: You are a chemist. Now you are given a representation of a molecule. Please help me to understand the molecule.

user: Provide a description of this molecule <molecule_2d> .

assistant: N-[(5R,6S,9S)-5-methoxy-8-(2-methoxy-1-oxoethyl)-3,6,9-trimethyl-2-oxo-11-oxa-3,8-diazabicyclo[10.4.0]hexadeca-1(12),13,15-trien-14-yl]methanesulfonamide is a lactam and an azamacrocycle.
Molecule SMILES: COC(=O)c1ccc2c(=O)c3c(OC)cc(CCO)cc3oc2c1O

system: You are a chemist. Now you are given a representation of a molecule. Please help me to understand the molecule.

user: Provide a brief overview of this molecule <molecule_2d> .

assistant: 1-Hydroxy-5-methoxy-3-hydroxyethyl-6-methoxycarbonylxanthone is a natural product found in Phomopsis with data available.
Molecule SMILES: O=[N+]([O-])c1c(Cl)cccc1-c1c[nH]cc1Cl

system: You are a chemist. Now you are given a representation of a molecule. Please help me to understand the molecule.

user: Please give me some details about this molecule <molecule_2d> .

assistant: Pyrrolnitrin is a member of the class of pyrroles carrying chloro and 3-chloro-2-nitrophenyl substituents at positions 3 and 4 respectively. It has a role as a bacterial metabolite and an antifungal drug. It is a member of pyrroles, a member of monochlorobenzenes, a C-nitro compound and an alkaloid.
Molecule SMILES: O=[N+]([O-])c1c(Cl)cccc1-c1c[nH]cc1Cl

system: You are a chemist. Now you are given a representation of a molecule. Please help me to understand the molecule.

user: <molecule_2d> What do you know about the molecule?

assistant: Pyrrolnitrin is a pyrrole antifungal agent isolated from several Pseudomonas species. Pyrrolnitrin interrupts the terminal electron transport system and inhibits cellular respiration. This agent has activity against dermatophytic fungi, especially species of Trichophyton.
Molecule SMILES: O=[N+]([O-])c1c(Cl)cccc1-c1c[nH]cc1Cl

system: You are a chemist. Now you are given a representation of a molecule. Please help me to understand the molecule.

user: Given the molecule <molecule_2d>, what can you tell me about it?

assistant: Pyrrolnitrin is a natural product found in Streptomyces phaeochromogenes, Pseudomonas, and other organisms with data available.
Molecule SMILES: Oc1ccc(C=Cc2ccc(O)cc2)cc1

system: You are a chemist. Now you are given a representation of a molecule. Please help me to understand the molecule.

user: Could you provide a description of this molecule <molecule_2d> ?

assistant: Stilbene-4,4'-diol is a stilbenol. It derives from a hydride of a stilbene.
Molecule SMILES: Oc1ccc(C=Cc2ccc(O)cc2)cc1

system: You are a chemist. Now you are given a representation of a molecule. Please help me to understand the molecule.

user: Please give me some details about this molecule <molecule_2d> .

assistant: 4,4'-Dihydroxystilbene is a natural product found in Yucca periculosa with data available.
Molecule SMILES: COc1cc(C(=O)Nc2c(Br)cc(Br)cc2CN(C)C2CCCCC2)ccc1OC(C)=O

system: You are a chemist. Now you are given a representation of a molecule. Please help me to understand the molecule.

user: Provide a description of this molecule <molecule_2d> .

assistant: Brovanexine is a member of benzamides.
Molecule SMILES: C=C1CCC2C3(C)CCCC2(COC3=O)C1CC(=O)c1ccoc1

system: You are a chemist. Now you are given a representation of a molecule. Please help me to understand the molecule.

user: Describe this molecule: <molecule_2d> .

assistant: (1R,2S,6R,7S)-2-[2-(furan-3-yl)-2-oxoethyl]-7-methyl-3-methylidene-9-oxatricyclo[5.3.3.01,6]tridecan-8-one is a natural product found in Sciadopitys verticillata with data available.
Molecule SMILES: CC(C)(O)C=CCC(C)(OC1OC(COC2OCC(O)C(O)C2O)C(O)C(O)C1O)C1CCC2(C)C1C(O)CC1C3(C)CC(O)C(O)C(C)(C)C3CCC12C

system: You are a chemist. Now you are given a representation of a molecule. Please help me to understand the molecule.

user: <molecule_2d> What do you know about the molecule?

assistant: 2-[6-hydroxy-6-methyl-2-(2,3,12-trihydroxy-4,4,8,10,14-pentamethyl-2,3,5,6,7,9,11,12,13,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-17-yl)hept-4-en-2-yl]oxy-6-[(3,4,5-trihydroxyoxan-2-yl)oxymethyl]oxane-3,4,5-triol is a natural product found in Gynostemma pentaphyllum with data available.
Molecule SMILES: CC(C=O)=CCc1cc(C=O)cc(O)c1O

system: You are a chemist. Now you are given a representation of a molecule. Please help me to understand the molecule.

user: Provide a description of this molecule <molecule_2d> .

assistant: Montadial is a natural product found in Bondarzewia mesenterica and Bondarzewia montana with data available.
Molecule SMILES: CC1CC2(C)CC(=O)OC3CCN4CCC(COC(=O)C1(C)O2)C34

system: You are a chemist. Now you are given a representation of a molecule. Please help me to understand the molecule.

user: Describe this molecule: <molecule_2d> .

assistant: 5,7,8-Trimethyl-2,10,19-trioxa-15-azatetracyclo[10.5.1.15,8.015,18]nonadecane-3,9-dione is a natural product found in Senecio nemorensis with data available.
Molecule SMILES: CC(C)(C)n1nnnc1C(c1cccnc1)N(Cc1ccccc1)Cc1cccs1

system: You are a chemist. Now you are given a representation of a molecule. Please help me to understand the molecule.

user: <molecule_2d> The above is a compound. Could you please tell me something about it?

assistant: 1-(1-tert-butyl-5-tetrazolyl)-N-(phenylmethyl)-1-(3-pyridinyl)-N-(thiophen-2-ylmethyl)methanamine is an aromatic amine.
Molecule SMILES: CC(C)CC(=O)CCCCCCCCC(=O)O

system: You are a chemist. Now you are given a representation of a molecule. Please help me to understand the molecule.

user: I'd like a short overview about this molecule <molecule_2d>. Can you do that?

assistant: 12-Methyl-10-oxotridecanoic acid is a long-chain fatty acid.
Molecule SMILES: CC1(O)CC23CCC4C(C)(CO)CCCC4(C)C2C(O)CC1C3

system: You are a chemist. Now you are given a representation of a molecule. Please help me to understand the molecule.

user: <molecule_2d> What do you know about the molecule?

assistant: (1S,4R,5R,9S,10S,11R,13S,14R)-5-(hydroxymethyl)-5,9,14-trimethyltetracyclo[11.2.1.01,10.04,9]hexadecane-11,14-diol is a natural product found in Diaporthe amygdali with data available.
Molecule SMILES: CC(CC(=O)CC(C)C1CC(O)C2(C)C3=C(C(=O)CC12C)C1(C)CCC(=O)C(C)(C)C1CC3)C(=O)O

system: You are a chemist. Now you are given a representation of a molecule. Please help me to understand the molecule.

user: Could you provide a description of this molecule <molecule_2d> ?

assistant: (2R,6R)-6-[(5S,10S,13R,14S,15S,17S)-15-hydroxy-4,4,10,13,14-pentamethyl-3,11-dioxo-2,5,6,7,12,15,16,17-octahydro-1H-cyclopenta[a]phenanthren-17-yl]-2-methyl-4-oxoheptanoic acid is a natural product found in Ganoderma lucidum with data available.
Molecule SMILES: COc1cc(O)c2c(c1)C(=O)C1(O)c3ccccc3C(C)(C)C1C2

system: You are a chemist. Now you are given a representation of a molecule. Please help me to understand the molecule.

user: <molecule_2d> The above is a compound. Could you please tell me something about it?

assistant: (4bR,10aR)-4b,9-dihydroxy-7-methoxy-11,11-dimethyl-10,10a-dihydrobenzo[b]fluoren-5-one is a natural product found in Carex distachya with data available.
Molecule SMILES: CC(=O)CCC=C(C)CCC=C(C)CCC(O)C(C)(C)O

system: You are a chemist. Now you are given a representation of a molecule. Please help me to understand the molecule.

user: Provide a description of this molecule <molecule_2d> .

assistant: (5E,9E,13R)-6,10,14-Trimethyl-13,14-dihydroxy-5,9-pentadecadiene-2-one is a natural product found in Cystophora moniliformis with data available.
Molecule SMILES: CC1CCCCOC(CN(C)Cc2ccc3c(c2)OCO3)C(C)CN(C(C)CO)C(=O)c2cc(N(C)C)ccc2O1

system: You are a chemist. Now you are given a representation of a molecule. Please help me to understand the molecule.

user: <molecule_2d> The above is a compound. Could you please tell me something about it?

assistant: (3R,9S,10R)-9-[[1,3-benzodioxol-5-ylmethyl(methyl)amino]methyl]-16-(dimethylamino)-12-[(2R)-1-hydroxypropan-2-yl]-3,10-dimethyl-2,8-dioxa-12-azabicyclo[12.4.0]octadeca-1(14),15,17-trien-13-one is a lactam and an azamacrocycle.
Molecule SMILES: O=C(Nc1ccc2c(c1)OCO2)NC1C=CC(CC(=O)N2CCN(c3ccccc3)CC2)OC1CO

system: You are a chemist. Now you are given a representation of a molecule. Please help me to understand the molecule.

user: Provide a brief overview of this molecule <molecule_2d> .

assistant: 1-(1,3-benzodioxol-5-yl)-3-[(2R,3R,6R)-2-(hydroxymethyl)-6-[2-oxo-2-(4-phenyl-1-piperazinyl)ethyl]-3,6-dihydro-2H-pyran-3-yl]urea is a member of piperazines.
Molecule SMILES: CC(=O)NC1C(O)OC(CO)C(OC2OC(CO)C(OC3OC(COC4OC(CO)C(O)C(O)C4O)C(O)C(O)C3O)C(O)C2NC(C)=O)C1O

system: You are a chemist. Now you are given a representation of a molecule. Please help me to understand the molecule.

user: I'd like a short overview about this molecule <molecule_2d>. Can you do that?

assistant: N-[(2S,3R,4R,5S,6R)-5-[(2R,3R,4R,5S,6R)-3-Acetamido-4-hydroxy-6-(hydroxymethyl)-5-[(2R,3S,4S,5S,6R)-3,4,5-trihydroxy-6-[[(2S,3S,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]oxan-2-yl]oxyoxan-2-yl]oxy-2,4-dihydroxy-6-(hydroxymethyl)oxan-3-yl]acetamide is an amino sugar.
Molecule SMILES: C=CC1(C)CC(=O)C2=C(CCC3C2(C)CCC(O)C3(C)C)C1O

system: You are a chemist. Now you are given a representation of a molecule. Please help me to understand the molecule.

user: <molecule_2d> The above is a compound. Could you please tell me something about it?

assistant: Agallochaol A is a natural product found in Excoecaria agallocha with data available.
Molecule SMILES: CCc1ccccc1NC(=O)NC1CCCCC1

system: You are a chemist. Now you are given a representation of a molecule. Please help me to understand the molecule.

user: Given the molecule <molecule_2d>, what can you tell me about it?

assistant: 1-cyclohexyl-3-(2-ethylphenyl)urea is a member of ureas.
Molecule SMILES: O=c1c(O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12

system: You are a chemist. Now you are given a representation of a molecule. Please help me to understand the molecule.

user: Could you give me a brief overview of this molecule <molecule_2d> ?

assistant: Quercetin appears as yellow needles or yellow powder. Converts to anhydrous form at 203-207 °F. Alcoholic solutions taste very bitter. (NTP, 1992)
Molecule SMILES: O=c1c(O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12

system: You are a chemist. Now you are given a representation of a molecule. Please help me to understand the molecule.

user: Please give me some details about this molecule <molecule_2d> .

assistant: Quercetin is a pentahydroxyflavone having the five hydroxy groups placed at the 3-, 3'-, 4'-, 5- and 7-positions. It is one of the most abundant flavonoids in edible vegetables, fruit and wine. It has a role as an antibacterial agent, an antioxidant, a protein kinase inhibitor, an antineoplastic agent, an EC 1.10.99.2 [ribosyldihydronicotinamide dehydrogenase (quinone)] inhibitor, a plant metabolite, a phytoestrogen, a radical scavenger, a chelator, an Aurora kinase inhibitor and a geroprotector. It is a pentahydroxyflavone and a 7-hydroxyflavonol. It is a conjugate acid of a quercetin-7-olate.
Molecule SMILES: O=c1c(O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12

system: You are a chemist. Now you are given a representation of a molecule. Please help me to understand the molecule.

user: <molecule_2d> What do you know about the molecule?

assistant: Quercetin is a flavonol widely distributed in plants. It is an antioxidant, like many other phenolic heterocyclic compounds. Glycosylated forms include RUTIN and quercetrin.
Molecule SMILES: O=c1c(O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12

system: You are a chemist. Now you are given a representation of a molecule. Please help me to understand the molecule.

user: Describe this molecule: <molecule_2d> .

assistant: Quercetin is a flavonoid found in many foods and herbs and is a regular component of a normal diet. Extracts of quercetin have been used to treat or prevent diverse conditions including cardiovascular disease, hypercholesterolemia, rheumatic diseases, infections and cancer but have not been shown to be effective in clinical trials for any medical condition. Quercetin as a nutritional supplement is well tolerated and has not been linked to serum enzyme elevations or to episodes of clinically apparent liver injury.
Molecule SMILES: O=c1c(O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12

system: You are a chemist. Now you are given a representation of a molecule. Please help me to understand the molecule.

user: I'd like a short overview about this molecule <molecule_2d>. Can you do that?

assistant: Quercetin is a polyphenolic flavonoid with potential chemopreventive activity. Quercetin, ubiquitous in plant food sources and a major bioflavonoid in the human diet, may produce antiproliferative effects resulting from the modulation of either EGFR or estrogen-receptor mediated signal transduction pathways. Although the mechanism of action of action is not fully known, the following effects have been described with this agent in vitro: decreased expression of mutant p53 protein and p21-ras oncogene, induction of cell cycle arrest at the G1 phase and inhibition of heat shock protein synthesis. This compound also demonstrates synergy and reversal of the multidrug resistance phenotype, when combined with chemotherapeutic drugs, in vitro. Quercetin also produces anti-inflammatory and anti-allergy effects mediated through the inhibition of the lipoxygenase and cyclooxygenase pathways, thereby preventing the production of pro-inflammatory mediators.
Molecule SMILES: O=c1c(O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12

system: You are a chemist. Now you are given a representation of a molecule. Please help me to understand the molecule.

user: Tell me something about this molecule: <molecule_2d>

assistant: Quercetin is a metabolite found in or produced by Escherichia coli (strain K12, MG1655).