IDEA-AI4S/PubChemSFT huggingface dataset:
Molecule SMILES: C=CC(C)(C)OC(C)C1NC(=O)C2CSC(=N2)C(C(C)C)NC(=O)C(C(C)OC(C)(C)C=C)NC(=O)C2CCCN2C(=O)C(C(C)C)NC(=O)C2CCCN2C(=O)C(CC(C)C)NC1=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 brief overview of this molecule <molecule_2d> .

assistant: 5,26-Bis[1-(2-methylbut-3-en-2-yloxy)ethyl]-23-(2-methylpropyl)-2,14-di(propan-2-yl)-31-thia-3,6,12,15,21,24,27,32-octazatetracyclo[27.2.1.08,12.017,21]dotriacont-1(32)-ene-4,7,13,16,22,25,28-heptone is a natural product found in Lissoclinum patella with data available.
Molecule SMILES: CC=C(C)C(=O)OC1CC(C)C(C)(CCC2=CC(=O)OC2)C2CC(O)C=C(C)C12C

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,3R,4R,4aS,6R,8aR)-6-hydroxy-3,4,8,8a-tetramethyl-4-[2-(5-oxo-2H-furan-3-yl)ethyl]-1,2,3,4a,5,6-hexahydronaphthalen-1-yl] (E)-2-methylbut-2-enoate is a natural product found in Solidago virgaurea with data available.
Molecule SMILES: CC(C)C(=O)Nc1nc2c(ncn2C2OC(CO)C(O)C2O)c(=O)[nH]1

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: N-Isobutyrylguanosine is a purine nucleoside.
Molecule SMILES: COc1cc(C=CC(=O)OC2CC3CC(OC(=O)c4cc(OC)c(OC)c(OC)c4)CC2N3C)cc(OC)c1OC

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: Tropane-3alpha,6beta-diol 3-(3,4,5-trimethoxybenzoate)6-(3,4,5-trimethoxycinnamate) is a natural product found in Erythroxylum pervillei with data available.
Molecule SMILES: CC1(C)CC2C(O)(C1)C(=O)c1coc(CO)c1C2(C)O

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: Sterostrein G is a natural product found in Stereum ostrea with data available.
Molecule SMILES: CC(C)=CC(O)CC(C)C1CCC2(C)C3=C(CCC12C)C1(C)CCC(=O)C(C)(C)C1CC3

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: (5R,10S,13R,14R,17R)-17-[(1R,3R)-3-hydroxy-1,5-dimethyl-hex-4-enyl]-4,4,10,13,14-pentamethyl-1,2,5,6,7,11,12,15,16,17-decahydrocyclopenta[a]phenanthren-3-one is a natural product found in Borrichia frutescens with data available.
Molecule SMILES: C=C(C(=O)O)C1CC=C(C)C(OC(C)=O)CC=C(C)CC1

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: 2-[(1R,3E,5R,7E)-5-acetyloxy-4,8-dimethylcyclodeca-3,7-dien-1-yl]prop-2-enoic acid is a natural product found in Haeckeria punctulata with data available.
Molecule SMILES: CCC(C)C(=O)NC1CCN2CCCC12

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: Laburnamine is a natural product found in Adenocarpus decorticans, Adenocarpus mannii, and other organisms with data available.
Molecule SMILES: CCCCCCC=CCC(=O)O

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: CID 85855 is a natural product found in Thymus longicaulis, Origanum vulgare, and Elsholtzia fruticosa with data available.
Molecule SMILES: CC(CCCC(C)C1CCC2C3C(O)CC4CC(O)CCC4(C)C3CCC12C)C(=O)SCCNC(=O)CCNC(=O)C(O)C(C)(C)COP(=O)(O)OP(=O)(O)OCC1OC(n2cnc3c(N)ncnc32)C(O)C1OP(=O)(O)O

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: 3alpha,7alpha-Dihydroxy-5beta-cholestanoyl-CoA is a metabolite found in or produced by Escherichia coli (strain K12, MG1655).
Molecule SMILES: Oc1ccc(C2Oc3c(c(O)cc(O)c3C3c4c(O)cc(O)cc4OC(c4ccc(O)c(O)c4)C3O)CC2O)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: 3,3',4',5,7-Pentahydroxyflavan(4->8)-3,4',5,7-tetrahydroxyflavan is a flavonoid oligomer.
Molecule SMILES: COc1cc(C(=O)O)c2c3c1C(=O)OC(C)C3CS2

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: Talarolactone A is a natural product found in Talaromyces with data available.
Molecule SMILES: ClC1=C(Cl)C2(Cl)C3C4C=CC(C4)C3C1(Cl)C2(Cl)Cl

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: Isodrin is a solid. This material is no longer used as a pesticide. Isomer of aldrin.
Molecule SMILES: CC1=C2C(=O)C=C(COC(=O)C(=O)O)C2C2OC(=O)C(C)C2C(OC(=O)Cc2ccc(O)cc2)C1

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: 11beta,13-dihydrolactucopicrin 15-oxalate is a sesquiterpene lactone obtained by formal condensation of one of the carboxy groups of oxalic acid with the 15-hydroxy group of 11beta,13-dihydrolactucopicrin. Found in chicory. It has a role as a plant metabolite. It is an azulenofuran, a cyclic terpene ketone, an enone, an oxo monocarboxylic acid, a member of phenols and a sesquiterpene lactone. It is functionally related to a 4-hydroxyphenylacetic acid, a lactucin and an oxalic acid.
Molecule SMILES: CCC(C)C(=O)OC1OCC23C(O)C(O)C(OC(C)=O)C1(C)C2CC(O)C1(C)C2C(=O)CC(c4ccoc4)C2(C)CC(=O)C13

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: [(1S,2S,5S,6R,9R,10S,11R,13R,14R,15S,18S,19R,20R)-20-acetyloxy-6-(furan-3-yl)-11,18,19-trihydroxy-5,10,14-trimethyl-3,8-dioxo-16-oxapentacyclo[12.3.3.01,13.02,10.05,9]icosan-15-yl] (2R)-2-methylbutanoate is a natural product found in Melia azedarach with data available.
Molecule SMILES: CC(=O)OC1CCC2(C)C3=C(CCC2C1(C)C)C1(C)CCC(C(CCC=C(C)C)C(=O)O)C1(C)CC3

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: Tsugaric acid A is a natural product found in Ganoderma and Ganoderma lucidum with data available.
Molecule SMILES: CC(=CCO)CCC=C(C)CCC(OC1OC(CO)C(O)C(O)C1O)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: Could you give me a brief overview of this molecule <molecule_2d> ?

assistant: (2S,3R,4S,5S,6R)-2-[(3S,6E,10E)-2,12-dihydroxy-2,6,10-trimethyldodeca-6,10-dien-3-yl]oxy-6-(hydroxymethyl)oxane-3,4,5-triol is a natural product found in Gynostemma yixingense with data available.
Molecule SMILES: COCC(=O)Nc1ccc2c(c1)C(=O)N(C)CC(OC)C(C)CN(C)C(C)CO2

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: 2-methoxy-N-[(4R,7R,8S)-8-methoxy-4,5,7,10-tetramethyl-11-oxo-2-oxa-5,10-diazabicyclo[10.4.0]hexadeca-1(12),13,15-trien-14-yl]acetamide is an azamacrocycle and a lactam.
Molecule SMILES: COCC(=O)N1C(CO)C(c2ccccc2)C1CNC(=O)c1ccccn1

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-[[(2R,3R,4R)-4-(hydroxymethyl)-1-(2-methoxy-1-oxoethyl)-3-phenyl-2-azetidinyl]methyl]-2-pyridinecarboxamide is a member of azetidines, a ring assembly and a member of benzenes.
Molecule SMILES: CC1=CCC2C3C1C2(C)CCCC3(C)C

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: (1S,2S,7S,8S)-2,6,6,9-tetramethyltricyclo[5.4.0.02,8]undec-9-ene is a natural product found in Artemisia annua, Pistacia vera, and other organisms with data available.
Molecule SMILES: CCOC(=O)c1cc(C)sc1N=CC1C(=O)CC(C)(C)CC1=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 give me a brief overview of this molecule <molecule_2d> ?

assistant: 2-[(4,4-dimethyl-2,6-dioxocyclohexyl)methylideneamino]-5-methyl-3-thiophenecarboxylic acid ethyl ester is a thiophenecarboxylic acid.
Molecule SMILES: C=C(C)C(O)Cc1c(O)cc2occ(-c3ccc(O)c(CC=C(C)C)c3O)c(=O)c2c1O

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: 3-[2,4-dihydroxy-3-(3-methylbut-2-enyl)phenyl]-5,7-dihydroxy-6-[(2R)-2-hydroxy-3-methylbut-3-enyl]chromen-4-one is a natural product found in Lupinus albus with data available.
Molecule SMILES: CC(=O)OC1CCC2(C)C(CCC3(C)C2CC=C2C4C(C)C(C)CCC4(C)CCC23C)C1(C)C

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: Alpha-Amyrin acetate is a triterpenoid.
Molecule SMILES: CC(=O)OC1CCC2(C)C(CCC3(C)C2CC=C2C4C(C)C(C)CCC4(C)CCC23C)C1(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 brief overview of this molecule <molecule_2d> .

assistant: alpha-Amyrenyl acetate is a natural product found in Ficus pandurata, Leontodon filii, and other organisms with data available.
Molecule SMILES: CC(=O)Oc1ccccc1C(=O)Oc1ccccc1

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: Phenyl acetylsalicylate is a carbonyl compound.
Molecule SMILES: Nc1cccc(N2CCOCC2)c1

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: 3-Morpholin-4-ylaniline is a member of morpholines.
Molecule SMILES: C=CC1(C)CCC2(C)C(CCC3(C)C(C)=C(O)C(=O)CC32)C1

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: Tagalsin G is a natural product found in Ceriops tagal with data available.
Molecule SMILES: COc1cc(OC2OC(C(=O)O)C(O)C(O)C2O)c(C2CC(=O)c3ccc(O)cc3O2)c(O)c1CC=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: Describe this molecule: <molecule_2d> .

assistant: 3,4,5-trihydroxy-6-[3-hydroxy-2-(7-hydroxy-4-oxo-3,4-dihydro-2H-1-benzopyran-2-yl)-5-methoxy-4-(3-methylbut-2-en-1-yl)phenoxy]oxane-2-carboxylic acid is a member of flavanones.
Molecule SMILES: COc1cc(C2Oc3c(OC)cc(C=CCO)cc3C2CO)ccc1OC1OC(CO)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: Given the molecule <molecule_2d>, what can you tell me about it?

assistant: (3S,5S,6S)-2-(hydroxymethyl)-6-[4-[(2S,3R)-3-(hydroxymethyl)-5-[(E)-3-hydroxyprop-1-enyl]-7-methoxy-2,3-dihydro-1-benzofuran-2-yl]-2-methoxyphenoxy]oxane-3,4,5-triol is a natural product found in Sanchezia oblonga and Sanchezia nobilis with data available.
Molecule SMILES: CC(=O)NC1C(OC2C(O)C(O)OC(CO)C2OC2OC(CO)C(O)C(O)C2O)OC(CO)C(OC2OC(CO)C(O)C(OC3(C(=O)O)CC(O)C(NC(C)=O)C(C(O)C(O)CO)O3)C2O)C1O

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: Alpha-Neup5Ac-(2->3)-beta-D-Galp-(1->4)-beta-D-GlcpNAc-(1->3)-[beta-D-Glcp-(1->4)]-beta-D-Galp is an amino pentasaccharide consisting of beta-D-galactose at the reducing end having a beta-D-glucosyl residue at the 4-position and an N-acetyl-alpha-neuraminyl-(2->3)-beta-D-galactosyl-(1->4)-N-acetyl-beta-D-glucosyl moiety at the 3-position. It is an amino pentasaccharide and a glucosamine oligosaccharide.
Molecule SMILES: C=C1C(=O)OC2C=C(C)CC(OC(C)=O)C=C(C)CC(OC(C)=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: [(3aR,4R,6E,8R,10E,11aR)-4-acetyloxy-6,10-dimethyl-3-methylidene-2-oxo-3a,4,5,8,9,11a-hexahydrocyclodeca[b]furan-8-yl] acetate is a natural product found in Eupatorium chinense with data available.
Molecule SMILES: COc1cc(OC)c2c(c1)C(CCCCCCCCCC(=O)CCC(C)=O)OC2=O

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: 14-(4,6-dimethoxy-3-oxo-1H-2-benzofuran-1-yl)tetradecane-2,5-dione is a natural product found in Phanerochaete velutina with data available.
Molecule SMILES: C=CCCCC(=NOS(=O)(=O)O)SC1OC(CO)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: [(2S,3S,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl] (1Z)-N-sulfooxyhex-5-enimidothioate is a natural product found in Schouwia purpurea, Arabidopsis thaliana, and other organisms with data available.
Molecule SMILES: CC12CCCc3coc(c31)C(=O)c1cc3c(cc12)C(=O)C1=C(NCCS1(=O)=O)C3=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: Adociaquinone B is a natural product found in Xestospongia with data available.
Molecule SMILES: CC(C)CCCCCC=CCCCCCCc1ccc(C=O)[nH]1

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: 5-(14-methylpentadec-7-enyl)-1H-pyrrole-2-carbaldehyde is a natural product found in Mycale with data available.
Molecule SMILES: COc1ccc(C2Oc3cc(OC)c(O)cc3C2C)cc1O

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: Melanoxin, (-)- is a member of benzofurans. It has a role as a metabolite.
Molecule SMILES: COc1ccc(C2Oc3cc(OC)c(O)cc3C2C)cc1O

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: (2S,3S)-2-(3-hydroxy-4-methoxyphenyl)-6-methoxy-3-methyl-2,3-dihydro-1-benzofuran-5-ol is a natural product found in Pterocarpus santalinus and Dalbergia melanoxylon with data available.
Molecule SMILES: O=P([O-])(OC1C(O)C(O)C(O)C(O)C1O)OC1C(O)C(O)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: Could you provide a description of this molecule <molecule_2d> ?

assistant: Bis(myo-inositol) 1,3'-phosphate is an inositol phosphate oxoanion.
Molecule SMILES: CC(N)Cc1ccccc1.CC(N)Cc1ccccc1.NC(CC(=O)O)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 give me a brief overview of this molecule <molecule_2d> ?

assistant: Amphetamine Aspartate is the aspartate salt of amphetamine, a sympathomimetic amine with CNS stimulating properties. Amphetamine acts by facilitating the release of catecholamines, particularly noradrenaline and dopamine, from nerve terminals in the brain and inhibiting their uptake. Physiological effects include an increase in motor activity, euphoria, increased mental alertness, excitatory behavior, and appetite suppression.
Molecule SMILES: [HH]

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: Tritium atom is the radioactive isotope of hydrogen with relative atomic mass 3.016049 and half-life of 12.33 years (from Greek taurhoiotatauomicronsigma, third). It contains a triton.
Molecule SMILES: CC(C)C(NC(=O)C([NH3+])CCC(=O)O)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: I'd like a short overview about this molecule <molecule_2d>. Can you do that?

assistant: Glutamylvaline is a natural product found in Euglena gracilis, Brassica napus, and Trypanosoma brucei with data available.
Molecule SMILES: CC1=C(CCC23COC(=O)C2=CCCC3O)C(=O)OC(c2ccoc2)C1

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: (3aS,4R)-3a-[2-[(2S)-2-(furan-3-yl)-4-methyl-6-oxo-2,3-dihydropyran-5-yl]ethyl]-4-hydroxy-3,4,5,6-tetrahydro-2-benzofuran-1-one is a natural product found in Salvia pansamalensis with data available.
Molecule SMILES: CC1=C(CCC2=CC(=O)OC2O)C2(C)CCCC(C)(C)C2C(O)C1=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: (2S)-3-[2-[(4S,4aR,8aS)-4-hydroxy-2,5,5,8a-tetramethyl-3-oxo-4a,6,7,8-tetrahydro-4H-naphthalen-1-yl]ethyl]-2-hydroxy-2H-furan-5-one is a natural product found in Leonurus sibiricus with data available.
Molecule SMILES: CC(C)(O)C1CCC(C)(C2CCC3(C)C2CC(O)C2C4(C)CCC(O)C(C)(C)C4CCC23C)O1

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: (3S,5S,8R,9R,10S,11R,13R,14R,17S)-17-[(2S,5R)-5-(2-hydroxypropan-2-yl)-2-methyloxolan-2-yl]-4,4,8,10,14-pentamethyl-2,3,5,6,7,9,11,12,13,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthrene-3,11-diol is a natural product found in Betula ermanii and Betula fruticosa with data available.
Molecule SMILES: CC(=O)OC1C(OC2CCC3(C)C(=CCC4C3CCC3(C)C4CC4OC5(CCC(C)CO5)C(C)C43)C2)OC(CO)C(OC2OC(CO)C(O)C(OC3OC(O)C(O)C(O)C3O)C2OC2OC(CO)C(O)C(O)C2O)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: [(2R,3R,4S,5R,6R)-4-hydroxy-5-[(2S,3R,4S,5R,6R)-5-hydroxy-6-(hydroxymethyl)-4-[(2S,3S,4R,5R,6R)-3,4,5,6-tetrahydroxyoxan-2-yl]oxy-3-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-6-(hydroxymethyl)-2-[(1S,2S,4S,5'S,6R,7S,8R,9S,12S,13R,16S)-5',7,9,13-tetramethylspiro[5-oxapentacyclo[10.8.0.02,9.04,8.013,18]icos-18-ene-6,2'-oxane]-16-yl]oxyoxan-3-yl] acetate is a natural product found in Polygonatum sibiricum with data available.
Molecule SMILES: CC1CCC2(C(=O)OC3OC(CO)C(O)C(O)C3O)CCC3(C)C(=CCC4C5(C)CC(O)C(O)C(CO)(CO)C5CCC43C)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: [(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl] (1S,2R,4aS,6aR,6aS,6bR,8aR,10R,11R,12aR,14bS)-10,11-dihydroxy-9,9-bis(hydroxymethyl)-1,2,6a,6b,12a-pentamethyl-2,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydro-1H-picene-4a-carboxylate is a natural product found in Combretum fruticosum and Combretum laxum with data available.
Molecule SMILES: CC1CCC2(OC1)OC1C(O)C3C4CCC5CC(OC6OC(CO)C(OC7OC(CO)C(O)C(OC8OCC(O)C(O)C8O)C7OC7OC(CO)C(O)C(OC8OC(CO)C(O)C(O)C8O)C7O)C(O)C6O)C(O)CC5(C)C4CCC3(C)C1C2C

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: Crystals or white powder. (NTP, 1992)
Molecule SMILES: CC1CCC2(OC1)OC1C(O)C3C4CCC5CC(OC6OC(CO)C(OC7OC(CO)C(O)C(OC8OCC(O)C(O)C8O)C7OC7OC(CO)C(O)C(OC8OC(CO)C(O)C(O)C8O)C7O)C(O)C6O)C(O)CC5(C)C4CCC3(C)C1C2C

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: Digitonin is a spirostanyl glycoside that is digitogenin in which the 3-hydroxy group is substituted by a beta-D-glucopyranosyl-(1->3)-beta-D-galactopyranosyl-(1->2)-[beta-D-xylopyranosyl-(1->3)]-beta-D-glucopyranosyl-(1->4)-beta-D-galactopyranosyl group. It is a steroidal saponin isolated from the foxglove plant, Digitalis purpurea. It is used extensively as a mild non-ionic detergent for extracting proteins from membranes for structure and function studies. It has a role as a detergent and a plant metabolite. It is a spirostanyl glycoside and a pentasaccharide derivative. It is functionally related to a digitogenin.
Molecule SMILES: CC1CCC2(OC1)OC1C(O)C3C4CCC5CC(OC6OC(CO)C(OC7OC(CO)C(O)C(OC8OCC(O)C(O)C8O)C7OC7OC(CO)C(O)C(OC8OC(CO)C(O)C(O)C8O)C7O)C(O)C6O)C(O)CC5(C)C4CCC3(C)C1C2C

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: Digitin is a natural product found in Digitalis ciliata, Digitalis ferruginea, and other organisms with data available.
Molecule SMILES: C=CC(C)=CC=CC(C)CC(=O)CC(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 brief overview of this molecule <molecule_2d> .

assistant: 2,6,10-Trimethyldodeca-7,9,11-trien-4-one is a natural product found in Plexaurella grisea with data available.
Molecule SMILES: COC(C)(C)c1ccc2c(c1)CCC1C(C)(C(=O)O)CCCC21C

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: Abiesadine N is a natural product found in Abies chensiensis and Pinus yunnanensis with data available.
Molecule SMILES: CCC=CCC(O)C=CC=CC=CC=CC(SCC(N)C(=O)NCC(=O)O)C(O)CC=CCCC(=O)O

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: (8S)-glycinylcystein-S-yl-(7R,17S)-dihydroxy-(4Z,9,11,13Z,15E,19Z)-docosahexaenoic acid is a docosanoid that is (7R,17S)-dihydroxy-(4Z,9,11,13Z,15E,19Z)-docosahexaenoic acid in which a cysteinylglycinyl group is attached at position 8S via a sulfide linkage. An intermediate of specialised proresolving mediators. It has a role as a specialised pro-resolving mediator and a human xenobiotic metabolite. It is a dicarboxylic acid, a dipeptide, a docosanoid, an organic sulfide and a secondary allylic alcohol. It is a conjugate acid of an (8S)-glycinylcystein-S-yl-(7R,17S)-dihydroxy-(4Z,9,11,13Z,15E,19Z)-docosahexaenoate(1-).