IDEA-AI4S/PubChemSFT huggingface dataset:
Molecule SMILES: CC1CCCCOC(CN(C)Cc2ccc(C(=O)O)cc2)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: Tell me something about this molecule: <molecule_2d>

assistant: 4-[[[(3R,9R,10R)-16-(dimethylamino)-12-[(2R)-1-hydroxypropan-2-yl]-3,10-dimethyl-13-oxo-2,8-dioxa-12-azabicyclo[12.4.0]octadeca-1(14),15,17-trien-9-yl]methyl-methylamino]methyl]benzoic acid is a lactam and an azamacrocycle.
Molecule SMILES: CCC(C)CC(N)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: <molecule_2d> The above is a compound. Could you please tell me something about it?

assistant: Homoisoleucine is a L-alpha-amino acid.
Molecule SMILES: CCC(C)CC(N)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: <molecule_2d> The above is a compound. Could you please tell me something about it?

assistant: (2S)-2-amino-4-methylhexanoic acid is a natural product found in Arabidopsis thaliana with data available.
Molecule SMILES: O=C(O)C#CC#CC#CC=CCO

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: 10-Hydroxydec-8-en-2,4,6-triynoic acid is a natural product found in Fayodia bisphaerigera with data available.
Molecule SMILES: CC1(C)OC1Cc1cc(C2COc3cc(O)cc(O)c3C2=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 brief overview of this molecule <molecule_2d> .

assistant: (3S)-3-[3-[[(2R)-3,3-dimethyloxiran-2-yl]methyl]-4,5-dihydroxyphenyl]-5,7-dihydroxy-2,3-dihydrochromen-4-one is a natural product found in Bolusanthus speciosus with data available.
Molecule SMILES: CC(C)=CC(CC(C)C1CCC2(C)C3=CCC4C(C)(C)C(OC5OC(CO)C(O)C(O)C5O)CC(OC5OC(CO)C(O)C(O)C5O)C4(C)C3CCC12C)OC1OC(C)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: Rhoipteleside D is a natural product found in Rhoiptelea chiliantha with data available.
Molecule SMILES: CSCCCCCCCC=NO

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: (E)-8-(methylsulfanyl)octanal oxime is a 8-(methylsulfanyl)octanal oxime in which the oxime moiety has E configuration. It is an omega-(methylsulfanyl)-(E)-alkanal oxime and an 8-(methylsulfanyl)octanal oxime.
Molecule SMILES: CSCCCCCCCC=NO

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: 8-Methylthiooctanaldoxime is a natural product found in Arabidopsis thaliana with data available.
Molecule SMILES: CCCCCCCCCCCCCCCCCC(=O)OCC1OC(OC2OC(CO)C(O)C(O)C2O)C(O)C(O)C1OC(=O)CCCCCCCCCCCCCCCCC

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: Alpha,alpha'-Trehalose 4,6-dioleate is a lipopolysaccharide.
Molecule SMILES: O=c1cccc(C2CC(CO)C3CCCCN3C2)[nH]1

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: Mamanine is a natural product found in Sophora chrysophylla and Sophora flavescens with data available.
Molecule SMILES: CC12C=CC3(CCC4C(C)(CO)CC(=O)C(O)C4(C)C3CC1)C2

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: (1R,4R,5R,8R,9S,10R,13S)-8-hydroxy-5-(hydroxymethyl)-5,9,13-trimethyltetracyclo[11.2.1.01,10.04,9]hexadec-14-en-7-one is a natural product found in Erythroxylum microphyllum with data available.
Molecule SMILES: CC(=O)C(C)=Cc1ccccc1

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-Methyl-4-phenyl-3-buten-2-one is a member of benzenes.
Molecule SMILES: CC(=O)NC1C(OC2C(O)OC(CO)C(OC3OC(CO)C(OC4OC(COC5(C(=O)O)CC(O)C(NC(C)=O)C(C(O)C(O)CO)O5)C(O)C(O)C4O)C(O)C3NC(C)=O)C2O)OC(CO)C(OC2OC(COC3(C(=O)O)CC(O)C(NC(C)=O)C(C(O)C(O)CO)O3)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: Given the molecule <molecule_2d>, what can you tell me about it?

assistant: (2R,4S,5R,6R)-5-Acetamido-2-[[(2R,3R,4S,5R,6S)-6-[(2R,3S,4R,5R,6S)-5-acetamido-6-[(2R,3R,4S,5R)-5-[(2S,3R,4R,5S,6R)-3-acetamido-5-[(2S,3R,4S,5R,6R)-6-[[(2R,4S,5R,6R)-5-acetamido-2-carboxy-4-hydroxy-6-[(1R,2R)-1,2,3-trihydroxypropyl]oxan-2-yl]oxymethyl]-3,4,5-trihydroxyoxan-2-yl]oxy-4-hydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4,6-dihydroxy-2-(hydroxymethyl)oxan-3-yl]oxy-4-hydroxy-2-(hydroxymethyl)oxan-3-yl]oxy-3,4,5-trihydroxyoxan-2-yl]methoxy]-4-hydroxy-6-[(1R,2R)-1,2,3-trihydroxypropyl]oxane-2-carboxylic acid is a member of neuraminic acids.
Molecule SMILES: CC1(C=O)CCCC2(C)C1CCC13CC(CCC12)C1(CO1)C3

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'S,2R,4'S,5'R,9'S,10'R,13'R)-5',9'-dimethylspiro[oxirane-2,14'-tetracyclo[11.2.1.01,10.04,9]hexadecane]-5'-carbaldehyde is a natural product found in Baccharis minutiflora with data available.
Molecule SMILES: CCCCCCCCC=CCCCCCCCC1(O)C(=O)C=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: Tell me something about this molecule: <molecule_2d>

assistant: (4S,5R,6R)-6-heptadec-8-enyl-4,5,6-trihydroxycyclohex-2-en-1-one is a natural product found in Pleiogynium timoriense with data available.
Molecule SMILES: COc1c(C(=O)CC(OC)c2ccc3c(c2)OCO3)ccc2occc12

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: Ponganone IX is a natural product found in Pongamia pinnata with data available.
Molecule SMILES: C=C(C)C1CCC2(C(=O)OC3OC(COC4OC(CO)C(OC5OC(C)C(O)C(O)C5O)C(O)C4O)C(O)C(O)C3O)CCC3(C)C(CC(O)C4C5(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: Describe this molecule: <molecule_2d> .

assistant: [(2S,3R,4S,5S,6R)-6-[[(2R,3R,4R,5S,6R)-3,4-dihydroxy-6-(hydroxymethyl)-5-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]oxymethyl]-3,4,5-trihydroxyoxan-2-yl] (1R,3aS,5aR,5bR,7aR,9R,11aS,11bR,12R,13aR,13bR)-9,12-dihydroxy-5a,5b,8,8,11a-pentamethyl-1-prop-1-en-2-yl-1,2,3,4,5,6,7,7a,9,10,11,11b,12,13,13a,13b-hexadecahydrocyclopenta[a]chrysene-3a-carboxylate is a natural product found in Eleutherococcus divaricatus, Eleutherococcus gracilistylus, and other organisms with data available.
Molecule SMILES: CCCCC=CC=CC#CC#CC=CCO

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: (2Z,8E,10E)-pentadeca-2,8,10-trien-4,6-diyn-1-ol is a natural product found in Bupleurum longiradiatum with data available.
Molecule SMILES: C=CC1C(OC2OC(COC(=O)C=Cc3ccc(O)c(OC)c3)C(O)C(O)C2O)OC=C2C(=O)N3CCc4c([nH]c5ccccc45)C3CC21

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: [(2R,3S,4S,5R,6S)-6-[[(1R,18S,19R,20S)-19-ethenyl-14-oxo-17-oxa-3,13-diazapentacyclo[11.8.0.02,10.04,9.015,20]henicosa-2(10),4,6,8,15-pentaen-18-yl]oxy]-3,4,5-trihydroxyoxan-2-yl]methyl (E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoate is a natural product found in Uncaria rhynchophylla with data available.
Molecule SMILES: N#CC1CCCc2c1[nH]c1ccc([N+](=O)[O-])cc21

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: 6-nitro-2,3,4,9-tetrahydro-1H-carbazole-1-carbonitrile is a member of carbazoles.
Molecule SMILES: COc1cc(-c2oc3cc(OC)c(OC)c(O)c3c(=O)c2OC)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: <molecule_2d> What do you know about the molecule?

assistant: Chrysosplenoside B is a natural product found in Chrysosplenium alternifolium with data available.
Molecule SMILES: COc1cc(O)c2c(c1)OC(c1ccc(OC3OC(CO)C(O)C(O)C3OC3OC(CO)C(O)C(O)C3O)cc1)CC2=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: (2S)-2-[4-[(2S,3R,4S,5S,6R)-4,5-dihydroxy-6-(hydroxymethyl)-3-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxyphenyl]-5-hydroxy-7-methoxy-2,3-dihydrochromen-4-one is a natural product found in Chromolaena odorata with data available.
Molecule SMILES: O=Cc1c(O)cc2c(c1O)C(=O)c1ccccc1C2=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: Nordamnacanthal is a natural product found in Damnacanthus major, Rubia argyi, and other organisms with data available.
Molecule SMILES: COc1cc(O)cc2c1C(=O)OC(C)CC=CCCCC2

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: 12E,15R-5-hydroxy-3-methoxy-16-methyl-8,9,10,11,14,15-hexahydro-1H-benzo[c][1]oxacyclodocecin-1-one is a natural product found in Lasiodiplodia with data available.
Molecule SMILES: Clc1ccc(C(Cn2ccnc2)OCc2c(Cl)cccc2Cl)c(Cl)c1.[H+]

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: (S)-isoconazole(1+) is an organic cation obtained by protonation of the imidazole group of (S)-isoconazole. It is a conjugate acid of a (S)-isoconazole. It is an enantiomer of a (R)-isoconazole(1+).
Molecule SMILES: CC1(C)Cc2c(sc3c2c(=N)n(Cc2ccco2)c(=O)n3CC(=O)Nc2ccc(Cl)cc2)CO1

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: N-(4-chlorophenyl)-2-[3-(2-furanylmethyl)-4-imino-6,6-dimethyl-2-oxo-5,8-dihydropyrano[2,3]thieno[2,4-b]pyrimidin-1-yl]acetamide is an organic heterobicyclic compound, an organonitrogen heterocyclic compound and an organosulfur heterocyclic compound.
Molecule SMILES: C=C1CCC2C(C)(CO)C(O)CCC2(C)C1C=CC(=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: (E)-3-[(1R,4aR,5R,6R,8aR)-6-hydroxy-5-(hydroxymethyl)-5,8a-dimethyl-2-methylidene-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]prop-2-enoic acid is a natural product found in Andrographis paniculata with data available.
Molecule SMILES: CNC1CCC2=CC3=CCC4(C)C(C(C)N(C)C)CCC4(C)C3CCC2C1(C)CO

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: [15-[1-(Dimethylamino)ethyl]-7,12,16-trimethyl-6-(methylamino)-7-tetracyclo[9.7.0.03,8.012,16]octadeca-1(18),2-dienyl]methanol is a natural product found in Buxus madagascarica with data available.
Molecule SMILES: CC1OC(OC2C(Oc3c(-c4ccc(O)c(O)c4)oc4cc(O)cc(O)c4c3=O)OC(CO)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: 3-[(2R,3S,4R,5S,6R)-4,5-dihydroxy-6-(hydroxymethyl)-3-[(2R,3S,4S,5S,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]oxy-2-(3,4-dihydroxyphenyl)-5,7-dihydroxychromen-4-one is a natural product found in Solanum nigrum with data available.
Molecule SMILES: C=CC(C(O)C(=C)C)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: Describe this molecule: <molecule_2d> .

assistant: (3R,4S)-2,5-dimethyl-3-vinyl-hex-5-ene-2,4-diol is a natural product found in Achillea filipendulina and Artemisia giraldii with data available.
Molecule SMILES: CCOC1OC(C)C(O)C(=O)C1OC(=O)c1c(C)cc(O)cc1O

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: Orsellide A1 is a natural product found in Chaetomium megalocarpum with data available.
Molecule SMILES: OCC1OC(O)(C(O)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,3R,4S,5S,6R)-2-[(1R)-1,2-dihydroxyethyl]-6-(hydroxymethyl)oxane-2,3,4,5-tetrol is a natural product found in Laurus with data available.
Molecule SMILES: CC(C)CCCCC=CC=CC(O)=NC(CC(=O)O)C(O)=NC1C(O)=NC(c2ccc(O)cc2)C(O)=NC(CCCN)C(O)=NC(C(C)O)C(O)=NC(c2ccc(O)cc2)C(O)=NC(c2ccc(O)cc2)C(O)=NC(C(C)O)C(O)=NC(CCCNC(=N)O)C(O)=NC(CC2CNC(=N)N2)C(O)=NC(c2ccc(O)c(Cl)c2)C(O)=NC(CO)C(O)=NC(c2cc(Cl)c(O)c(Cl)c2)C(O)=NCC(O)=NC(CC2CNC(=N)N2)C(O)=NC(C)C(O)=NC(c2ccc(O)cc2)C(=O)OC1C

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: CID 75149193 is a natural product found in Streptomyces fungicidicus with data available.
Molecule SMILES: COc1ccc2cc1Oc1cc(ccc1OC)C(O)C13SSSSC4(C(=O)N1C)C(O)C1=COC=CC(OC2=O)C1N4C3=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: Emestrin E is a natural product found in Cladorrhinum with data available.
Molecule SMILES: C=Cc1ccc(OC2OC(CO)C(O)C(O)C2O)cc1

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: (2S,3S,4R,5R)-2-(4-ethenylphenoxy)-6-(hydroxymethyl)oxane-3,4,5-triol is a natural product found in Streptomyces with data available.
Molecule SMILES: CC(=O)OCC1=CC(OC(C)=O)C2(C)CC(OC(C)=O)C(C)=C(C(OC(C)=O)C(OC(C)=O)=C(C)C(OC(C)=O)CC1OC(=O)C=Cc1ccccc1)C2(C)C

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: [(1R,2S,3E,5S,7S,8E,10R,13S)-2,7,9,10,13-pentaacetyloxy-4-(acetyloxymethyl)-1,8,12,15,15-pentamethyl-5-bicyclo[9.3.1]pentadeca-3,8,11-trienyl] (E)-3-phenylprop-2-enoate is a natural product found in Taxus wallichiana with data available.
Molecule SMILES: Cc1c2nc(N)nc-2ccc2[nH]c(N)nc12

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: Parazoanthoxanthin A is a natural product found in Parazoanthus axinellae with data available.
Molecule SMILES: Nc1nc2c(c(=O)[nH]1)NC1C(N2)OC2COP(=O)(O)OC2C1(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> What do you know about the molecule?

assistant: Precursor Z hydrate is a linear-fused organic heterotetracyclic compound consisting of a [1,3,2]dioxaphosphinane fused to a pyran ring which is in turn fused to a pteridine ring system. Molybdenum cofactor biosynthesis intermediate. Dehydrated derivative known as precursor Z. It has a role as an Escherichia coli metabolite. It is an organic heterotetracyclic compound, an oxacycle, an organonitrogen heterocyclic compound and a ketone hydrate.
Molecule SMILES: Nc1nc2c(c(=O)[nH]1)NC1C(N2)OC2COP(=O)(O)OC2C1(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: Fosdenopterin is a Cyclic Pyranopterin Monophosphate.
Molecule SMILES: Nc1nc2c(c(=O)[nH]1)NC1C(N2)OC2COP(=O)(O)OC2C1(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: Molybdenum cofactor deficiency (MoCD) is an exceptionally rare autosomal recessive disorder resulting in a deficiency of three molybdenum-dependent enzymes: sulfite oxidase (SOX), xanthine dehydrogenase, and aldehyde oxidase. Signs and symptoms begin shortly after birth and are caused by a build-up of toxic sulfites resulting from a lack of SOX activity. Patients with MoCD may present with metabolic acidosis, intracranial hemorrhage, feeding difficulties, and significant neurological symptoms such as muscle hyper- and hypotonia, intractable seizures, spastic paraplegia, myoclonus, and opisthotonus. In addition, patients with MoCD are often born with morphologic evidence of the disorder such as microcephaly, cerebral atrophy/hypodensity, dilated ventricles, and ocular abnormalities. MoCD is incurable and median survival in untreated patients is approximately 36 months - treatment, then, is focused on improving survival and maintaining neurological function.  The most common subtype of MoCD, type A, involves mutations in MOCS1 wherein the first step of molybdenum cofactor synthesis - the conversion of guanosine triphosphate into cyclic pyranopterin monophosphate (cPMP) - is interrupted. In the past, management strategies for this disorder involved symptomatic and supportive treatment, though efforts were made to develop a suitable exogenous replacement for the missing cPMP. In 2009 a recombinant, E. coli-produced cPMP was granted orphan drug designation by the FDA, becoming the first therapeutic option for patients with MoCD type A.  Fosdenopterin was approved by the FDA on Februrary 26, 2021, for the reduction of mortality in patients with MoCD type A, becoming the first and only therapy approved for the treatment of MoCD. By improving the three-year survival rate from 55% to 84%, and considering the lack of alternative therapies available, fosdenopterin appears poised to become a standard of therapy in the management of this debilitating disorder.  In July 2022, the EMA's Committee for Medicinal Products for Human Use (CHMP) recommended fosdenopterin be granted marketing authorization under exceptional circumstances for the treatment of patients with molybdenum cofactor deficiency (MoCD) Type A. In September 2022, the EMA approved the use of fosdenopterin.
Molecule SMILES: Nc1nc2c(c(=O)[nH]1)NC1C(N2)OC2COP(=O)(O)OC2C1(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: Cyclic pyranopterin monophosphate is a metabolite found in or produced by Escherichia coli (strain K12, MG1655).
Molecule SMILES: C=C1CCCC2(C)CCC(C(O)C(C)C)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 provide a description of this molecule <molecule_2d> ?

assistant: trans-Dracunculifoliol is a natural product found in Baccharis dracunculifolia with data available.
Molecule SMILES: COc1cccc(C2OC(CC(=O)N3CCC(CC(=O)O)CC3)C(=O)N(CC(C)(C)CO)c3ccc(Cl)cc32)c1OC

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: Lapaquistat is under investigation in clinical trial NCT00256178 (Efficacy of Lapaquistat Acetate and Simvastatin in Subjects With Primary Dyslipidemia.).
Molecule SMILES: COc1cccc(C2OC(CC(=O)N3CCC(CC(=O)O)CC3)C(=O)N(CC(C)(C)CO)c3ccc(Cl)cc32)c1OC

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: Lapaquistat is an inhibitor of squalene synthase, an enzyme downstream of HMG-CoA reductase in the synthesis of cholesterol. Squalene synthase catalyzes the dimerization of farnesyl-pyrophosphate to squalene, the first step in the cholesterol biosynthetic pathway that is solely committed to the production of cholesterol. Development of this agent was haulted do to potential hepatic toxicity.
Molecule SMILES: CC1CCC2(O)C(C=O)=COC(OC3OC(CO)C(O)C(O)C3O)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: (1S,4aR,7R,7aR)-4a-hydroxy-7-methyl-1-[(2R,3S,4R,5R,6S)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-5,6,7,7a-tetrahydro-1H-cyclopenta[c]pyran-4-carbaldehyde is a natural product found in Leucocarpus perfoliatus with data available.
Molecule SMILES: C=C1CCC(C(C)C)C(O)C=C(C)C(O)CC1=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: (3R,4E,6R,7S)-3,6-dihydroxy-4-methyl-10-methylidene-7-propan-2-ylcyclodec-4-en-1-one is a natural product found in Santolina insularis with data available.
Molecule SMILES: COCc1c(O)c2cc(O)c(CO)cc2oc1=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: 4,6-Dihydroxy-7-hydroxymethyl-3-methoxymethylcoumarin is a natural product found in Pestalotiopsis crassiuscula with data available.
Molecule SMILES: CCCCCCCCCCCCCCCC(=O)OCC1(O)CC2C3=CCC4C5(C)CCC(OC(C)=O)C(C)(C)C5CCC4(C)C3(C)CCC2(C)C(OC(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: Provide a description of this molecule <molecule_2d> .

assistant: 3alpha,22alpha-Diacetoxy-20beta,21alpha-dihydroxy-29-(palmitoyloxy)-30-noroleana-12-ene is a natural product found in Saussurea muliensis with data available.
Molecule SMILES: O=C(O)C1CC(O)(C2(O)OCC(O)C2O)C(=O)N1

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: Ascorbalamic acid is a proline derivative.