IDEA-AI4S/PubChemSFT huggingface dataset:
Molecule SMILES: COC(=O)C1(C)CCC2(C(=O)OC3OC(CO)C(O)C(O)C3O)CCC3(C)C(=CCC4C5(C)CCC(OC6OC(COC7OCC(O)C(O)C7O)C(O)C(O)C6O)C(C)(CO)C5CCC43C)C2C1

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: 2-O-methyl 4a-O-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl] (2S,4aR,6aR,6aS,6bR,8aR,9R,10S,12aR,14bS)-9-(hydroxymethyl)-2,6a,6b,9,12a-pentamethyl-10-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-[[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxymethyl]oxan-2-yl]oxy-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-2,4a-dicarboxylate is a natural product found in Phytolacca dodecandra with data available.
Molecule SMILES: CC=Cc1ccc(C2C(CO)N(C(=O)C3CCCCC3)C23CN(C(=O)NC(C)C)C3)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 give me a brief overview of this molecule <molecule_2d> ?

assistant: LSM-40925 is a member of benzenes, a ring assembly and a member of azetidines.
Molecule SMILES: COC1CC(OC2CCC3(C)C(=CCC4C3CCC3(C)C(C(C)OC5OC(CO)C(O)C(O)C5O)CCC43O)C2)OC(C)C1OC1OC(C)C(O)C(OC)C1O

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: Hoodigoside Y is a natural product found in Hoodia gordonii with data available.
Molecule SMILES: C=C1CC23CCC4C(C)(C(=O)OC)CCCC4(C)C2CC(OC(C)=O)C1C3

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: methyl (1S,4S,5R,9S,10R,12S,13R)-12-acetyloxy-5,9-dimethyl-14-methylidenetetracyclo[11.2.1.01,10.04,9]hexadecane-5-carboxylate is a natural product found in Helianthus simulans with data available.
Molecule SMILES: O=C1C(=O)N(Cc2ccc(-c3ccsc3)cc2)c2ccc(OC(F)(F)F)cc21

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: 1-[[4-(3-thiophenyl)phenyl]methyl]-5-(trifluoromethoxy)indole-2,3-dione is a member of indoles.
Molecule SMILES: CCCN(C)CC1OCCCCC(C)Oc2ccc(NS(=O)(=O)c3ccc(F)cc3)cc2C(=O)N(C(C)CO)CC1C

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-fluoro-N-[(3R,9S,10S)-12-[(2R)-1-hydroxypropan-2-yl]-3,10-dimethyl-9-[[methyl(propyl)amino]methyl]-13-oxo-2,8-dioxa-12-azabicyclo[12.4.0]octadeca-1(14),15,17-trien-16-yl]benzenesulfonamide is an azamacrocycle and a lactam.
Molecule SMILES: COC1=C(c2cc(-c3cc(-c4c(O)cc(O)c5c4CC(C)NC5C)c4cc(C)cc(OC)c4c3O)c(O)c3c(OC)cc(C)cc23)C(=O)C=C2CC(C)NC(C)=C21

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)-7-[3-[4-[(1R,3R)-6,8-dihydroxy-1,3-dimethyl-1,2,3,4-tetrahydroisoquinolin-5-yl]-1-hydroxy-8-methoxy-6-methylnaphthalen-2-yl]-4-hydroxy-5-methoxy-7-methylnaphthalen-1-yl]-8-methoxy-1,3-dimethyl-3,4-dihydro-2H-isoquinolin-6-one is a natural product found in Ancistrocladus korupensis with data available.
Molecule SMILES: CC(=O)OCCC(CO)c1c(O)cc2c(c1O)C(=O)c1c(O)cc(O)cc1C2=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: (3S)-versiconol acetate is an optically active form of versiconol acetate having 3S-configuration.
Molecule SMILES: CC(=O)OCCC(CO)c1c(O)cc2c(c1O)C(=O)c1c(O)cc(O)cc1C2=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: (3S)-versiconol acetate is a natural product found in Bipolaris sorokiniana with data available.
Molecule SMILES: C=C1CCCC2(C)CCC(C(C)(C)O)CC12

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: 2-[(2S,4aS,8aS)-4a-methyl-8-methylidene-1,2,3,4,5,6,7,8a-octahydronaphthalen-2-yl]propan-2-ol is a natural product found in Eucalyptus spathulata with data available.
Molecule SMILES: Fc1ccc(-c2csc(=S)[nH]2)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: 4-(4-fluorophenyl)-3H-thiazole-2-thione is an organofluorine compound.
Molecule SMILES: CCCCCC(O)c1c(O)cc2c(c1O)C(=O)c1c(cc(O)c(Cl)c1O)C2=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: 1,3,6,8-Tetrahydroxy-2-[(S)-1-hydroxyhexyl]-7-chloro-9,10-anthraquinone is a natural product found in Aspergillus with data available.
Molecule SMILES: Br.CN(C)CCCC1(c2ccc(F)cc2)OCc2cc(C#N)ccc21

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: (R)-citalopram hydrobromide is a 1-[3-(dimethylamino)propyl]-1-(4-fluorophenyl)-1,3-dihydro-2-benzofuran-5-carbonitrile hydrobromide resulting from the reaction of equimolar amounts of (R)-citalopram and hydrogen bromide. It is an enantiomer of an escitalopram hydrobromide.
Molecule SMILES: O=P([O-])([O-])OCC1OC(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: Alpha-D-Ribose 5-phosphate(2-) is an organic molecular entity.
Molecule SMILES: CC1C(=O)COC2C1CC(O)C2(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: (4R,4aR,6S,7R,7aS)-6,7-dihydroxy-4,7-dimethyl-4a,5,6,7a-tetrahydro-4H-cyclopenta[b]pyran-3-one is a natural product found in Patrinia scabra with data available.
Molecule SMILES: C=C(C)C(C=CC(C)C1CCC2C3CCC4CC(O)CCC4(C)C3CCC12C)CC

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: (3S,5S,8R,9S,10S,13R,14S,17R)-17-[(2R,3E,5S)-5-ethyl-6-methylhepta-3,6-dien-2-yl]-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-3-ol is a natural product found in Clerodendrum umbellatum with data available.
Molecule SMILES: CCCCCCCCC=CCCCCCCCCCCCCCC(=O)NC(COC1OC(CO)C(O)C(O)C1O)C(O)C(O)CCCCCCCCCCCCCC

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-O-(alpha-D-galactosyl)-N-[(15Z)-tetracos-15-enoyl]phytosphingosine is a glycophytoceramide that consists of phytosphingosine having an alpha-D-galactosyl attached at the O-1 position via a glycosidic linkage and a (Z)-tetracos-15-enoyl group attached to the nitrogen.
Molecule SMILES: COC(=O)C(=Cc1cc(OC)cc(OC)c1)c1ccc(Oc2ccc(CC3SC(=O)NC3=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: Describe this molecule: <molecule_2d> .

assistant: CLX-0921 is investigated for use/treatment in diabetes mellitus type 2. CLX-0921 is a solid. CLX-0921 has a spectrum of activity that differs from commercially available thiazolidinediones. This substance targets the protein peroxisome proliferator-activated receptor gamma. It is a pharmacologically active antihyperglycemic agent that acts by increasing peripheral tissue sensitivity to insulin.
Molecule SMILES: O=C(C=Cc1ccc(O)c(O)c1)OC(C(=O)O)C(O)C(OC(=O)C=Cc1ccc(O)c(O)c1)C(OC(=O)C=Cc1ccc(O)c(O)c1)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: (2S,3S,4S,5R)-2,3,5-tris[[(E)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxy]-4-hydroxyhexanedioic acid is a natural product found in Smallanthus sonchifolius with data available.
Molecule SMILES: CC=C(C)C(=O)OC1CCC2Cc3occ(C)c3C(OC(=O)C(C)=CC)C2(C)C1C(=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: (4S,4aR,5R,6S,8aR)-3,4a-dimethyl-4,6-bis[[(Z)-2-methylbut-2-enoyl]oxy]-5,6,7,8,8a,9-hexahydro-4H-benzo[f][1]benzofuran-5-carboxylic acid is a natural product found in Othonna with data available.
Molecule SMILES: CCC=CCC=CCC=CCCCCCCCC(=O)OCC(COC(=O)CCCCCCCC=CCC=CCC=CCC)OC(=O)CCCCCCCCCCCCC

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: TG(18:3(9Z,12Z,15Z)/14:0/18:3(9Z,12Z,15Z))[iso3] is a triacylglycerol 50:6.
Molecule SMILES: O=c1cc2oc3c1c(O)cc(O)c3c1c(O)c(O)ccc1c1cc(=O)c3c(O)cc(O)c(c3o1)c1c(O)c(O)ccc21

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: 3,4,12,14,17,18,26,28-Octahydroxy-9,30-dioxaheptacyclo[20.6.2.28,11.02,7.010,15.016,21.025,29]dotriaconta-1(28),2(7),3,5,8(32),10,12,14,16(21),17,19,22,25(29),26-tetradecaene-24,31-dione is a natural product found in Bartramia mossmaniana, Anacolia laevisphaera, and Bartramia pomiformis with data available.
Molecule SMILES: COc1ccc(OC(=O)N(C)CC2OCc3cnnn3CCCC(=O)N(C(C)CO)CC2C)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: N-[[(8S,9R)-6-[(2R)-1-hydroxypropan-2-yl]-8-methyl-5-oxo-10-oxa-1,6,14,15-tetrazabicyclo[10.3.0]pentadeca-12,14-dien-9-yl]methyl]-N-methylcarbamic acid (4-methoxyphenyl) ester is an azamacrocycle and a lactam.
Molecule SMILES: Cc1cc(O)c(OC2OC(CO)C(O)C(O)C2O)cc1C(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: 2-(Hydroxymethyl)-6-(2-hydroxy-4-methyl-5-propan-2-ylphenoxy)oxane-3,4,5-triol is a natural product found in Cupressus sempervirens with data available.
Molecule SMILES: CC1OC(OC2C(OC3CCC4(C)C(CCC5(C)C4CC=C4C6CC(C)(C)CCC6(CO)C(O)CC45C)C3(C)C)OC(CO)C(OC3OC(COC4OC(CO)C(O)C(O)C4O)C(O)C(O)C3O)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: Please give me some details about this molecule <molecule_2d> .

assistant: (2S,3R,4R,5R,6S)-2-[(2R,3R,4S,5R,6R)-2-[[(3S,4aR,6aR,6bS,8R,8aS,12aS,14aR,14bR)-8-hydroxy-8a-(hydroxymethyl)-4,4,6a,6b,11,11,14b-heptamethyl-1,2,3,4a,5,6,7,8,9,10,12,12a,14,14a-tetradecahydropicen-3-yl]oxy]-4-hydroxy-6-(hydroxymethyl)-5-[(2S,3R,4S,5R,6R)-3,4,5-trihydroxy-6-[[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]oxan-2-yl]oxyoxan-3-yl]oxy-6-methyloxane-3,4,5-triol is a natural product found in Primula elatior with data available.
Molecule SMILES: COc1ccc2nc3cc(Cl)ccc3c(NC(C)CCCN(CCCl)CCCl)c2c1.[Cl-].[Cl-].[H+].[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 give me a brief overview of this molecule <molecule_2d> ?

assistant: Quinacrine mustard dihydrochloride is a hydrochloride. It has a role as an intercalator. It contains a quinacrine mustard.
Molecule SMILES: COc1cc(CC2C(=O)OCC2Cc2cc(OC)c(O)c(OC)c2)ccc1O

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: 4-[(4-Hydroxy-3,5-dimethoxyphenyl)methyl]-3-[(4-hydroxy-3-methoxyphenyl)methyl]oxolan-2-one is a natural product found in Torreya nucifera with data available.
Molecule SMILES: CC=C(N=C(O)C(C)N=C(O)C1CCCN1C(=O)C(=CC)N1CN(C)C(C)C1=O)C(=O)N1CCCC1C(O)=NC(=CC)C(O)=NC(C)C(O)=NC(C)C(O)=NC(CCC(=N)O)C(O)=NC(Cc1ccccc1)C(O)=NC(C(O)=NC(C(O)=NC(CCC(=N)O)C(O)=NCC(O)=NC(CO)C(O)=NC(=CC)C(O)=NC(C(O)=NC1CSC=CN=C(O)C(C(C)C)N=C(O)C(CC(C)C)N=C1O)C(C)CC)C(C)CC)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: <molecule_2d> What do you know about the molecule?

assistant: Salinipeptin C is a natural product found in Streptomyces with data available.
Molecule SMILES: COC(=O)C1CCN(C(=O)c2cc3ccccc3oc2=O)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: 1-[oxo-(2-oxo-1-benzopyran-3-yl)methyl]-4-piperidinecarboxylic acid methyl ester is a member of coumarins.
Molecule SMILES: CC1(C)CCC(=O)C(C)(O)C12CC=C(C=O)CC2

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: Acaciicolinol A is a natural product found in Pseudolagarobasidium acaciicola with data available.
Molecule SMILES: CC(=O)C1(O)Cc2cc3c(c(O)c2C(OC2CC(N)C(O)C(C)O2)C1)C(=O)c1c(O)cccc1C3=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: 4-O-demethyl-11-deoxydaunorubicin is a natural product found in Streptomyces aureus with data available.
Molecule SMILES: CC(C)Cc1ncc(C(O)C(C)C)n(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: Describe this molecule: <molecule_2d> .

assistant: Neohydroxyaspergillic Acid is a natural product found in Aspergillus sclerotiorum with data available.
Molecule SMILES: CC(O)Cc1c(Br)c(O)c2c(=O)c3c(O)c(Br)c(O)c4c5c(O)c(Br)c(O)c6c(=O)c7c(O)c(Br)c(CC(C)OS(=O)(=O)O)c8c1c2c(c34)c(c65)c78

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: Gymnochrome C is a natural product found in Neogymnocrinus richeri with data available.
Molecule SMILES: O=C(C=Cc1ccc(O)c(O)c1)OC1CC(O)(C(=O)[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: Chlorogenate is a monocarboxylic acid anion that is the conjugate base of chlorogenic acid; major species at pH 7.3. It has a role as a plant metabolite. It is functionally related to a (-)-quinate. It is a conjugate base of a chlorogenic acid.
Molecule SMILES: CC=CCC=CCC=CCC=CCC=CCCCCC(=O)OC

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: methyl (6Z,9Z,12Z,15Z,18Z)-icosa-6,9,12,15,18-pentaenoate is a natural product found in Saprolegnia with data available.
Molecule SMILES: CC1CN(C(C)CO)S(=O)(=O)c2ccc(C#Cc3ccccc3F)cc2OC1CN(C)C(=O)Cc1ccncc1

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: N-[[(4S,5R)-8-[2-(2-fluorophenyl)ethynyl]-2-[(2S)-1-hydroxypropan-2-yl]-4-methyl-1,1-dioxo-4,5-dihydro-3H-6,1$l^{6},2-benzoxathiazocin-5-yl]methyl]-N-methyl-2-pyridin-4-ylacetamide is an organofluorine compound.
Molecule SMILES: CC(=O)NC1C(O)OC(CO)C(OC2OC(CO)C(OC3OC(COC4OC(CO)C(OC5OC(CO)C(OC6OC(COC7(C(=O)O)CC(O)C(NC(C)=O)C(C(O)C(O)CO)O7)C(O)C(O)C6O)C(O)C5NC(C)=O)C(O)C4OC4OC(CO)C(OC5OC(COC6(C(=O)O)CC(O)C(NC(C)=O)C(C(O)C(O)CO)O6)C(O)C(O)C5O)C(O)C4NC(C)=O)C(O)C(OC4OC(CO)C(O)C(O)C4OC4OC(CO)C(OC5OC(CO)C(O)C(OC6(C(=O)O)CC(O)C(NC(C)=O)C(C(O)C(O)CO)O6)C5O)C(O)C4NC(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: <molecule_2d> The above is a compound. Could you please tell me something about it?

assistant: CID 91851346 is a polysaccharide.
Molecule SMILES: CCOC(C)c1c(C)cc(O)c(CC=C(C)CCC=C(C)CCC=C(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> What do you know about the molecule?

assistant: 4-[(1R)-1-ethoxyethyl]-5-methyl-2-[(2E,6E)-3,7,11-trimethyldodeca-2,6,10-trienyl]benzene-1,3-diol is a natural product found in Baorangia pseudocalopus with data available.
Molecule SMILES: C=CC=CCC=CCC=CCCCCCCCCCCC

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: 1,3,6,9-Henicosatetraene is a natural product found in Utetheisa ornatrix with data available.
Molecule SMILES: COc1cc(OC)c(C2C=CCCC23C(=O)CC2C(C)(C)CCCC2(C)C3CC=C2CCOC2=O)cc1OC

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: (3E)-3-[2-[(1R,2R,3'S,4aS,8aS)-5,5,8a-trimethyl-3-oxo-3'-(2,4,5-trimethoxyphenyl)spiro[1,4,4a,6,7,8-hexahydronaphthalene-2,4'-cyclohexene]-1-yl]ethylidene]oxolan-2-one is a natural product found in Alpinia flabellata with data available.
Molecule SMILES: Nc1ccccc1NC(=O)c1ccc(CNC(=O)OCc2cccnc2)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 give me a brief overview of this molecule <molecule_2d> ?

assistant: Entinostat is a member of the class of benzamides resulting from the formal condensation of the carboxy group of the pyridin-3-ylmethyl carbamate derivative of p-(aminomethyl)benzoic acid with one of the amino groups of benzene-1,2-diamine. It is an inhibitor of histone deacetylase isoform 1 (HDAC1) and isoform 3 (HDAC3). It has a role as an EC 3.5.1.98 (histone deacetylase) inhibitor, an antineoplastic agent and an apoptosis inducer. It is a member of pyridines, a carbamate ester, a substituted aniline, a primary amino compound and a member of benzamides. It is functionally related to a 1,2-phenylenediamine.
Molecule SMILES: Nc1ccccc1NC(=O)c1ccc(CNC(=O)OCc2cccnc2)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 give me a brief overview of this molecule <molecule_2d> ?

assistant: Entinostat is under investigation for the treatment and other of Volunteers, Breast Cancer, Human Volunteers, and Normal Volunteers. Entinostat has been investigated for the treatment of Non-Small Lung Cancer, Epigenetic Therapy.
Molecule SMILES: Nc1ccccc1NC(=O)c1ccc(CNC(=O)OCc2cccnc2)cc1

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: Entinostat is a synthetic benzamide derivative with potential antineoplastic activity. Entinostat binds to and inhibits histone deacetylase, an enzyme that regulates chromatin structure and gene transcription. This agent appears to exert dose-dependent effects in human leukemia cells including cyclin-dependent kinase inhibitor 1A (p21/CIP1/WAF1)-dependent growth arrest and differentiation at low drug concentrations; a marked induction of reactive oxygen species (ROS); mitochondrial damage; caspase activation; and, at higher concentrations, apoptosis. In normal cells, cyclin-dependent kinase inhibitor 1A expression has been associated with cell-cycle exit and differentiation.
Molecule SMILES: CC(C)CC=CC(C)C1CCC2(C)C3=CCC4CC(O)CCC4(C)C3CCC12C

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,9R,10S,13R,14R,17R)-10,13,14-trimethyl-17-[(E,2R)-6-methylhept-3-en-2-yl]-1,2,3,4,5,6,9,11,12,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-ol is a natural product found in Holothuria arenicola with data available.
Molecule SMILES: CC1=CCC(C(C)C)C(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: Provide a brief overview of this molecule <molecule_2d> .

assistant: 2-Cyclohexen-1-one, 6-hydroxy-2-methyl-5-(1-methylethyl)- is a natural product found in Laggera alata with data available.
Molecule SMILES: COc1cc2oc(=O)ccc2cc1C=CC(C)(O)CO

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: 6-(3,4-dihydroxy-3-methylbut-1-en-1-yl)-7-methoxy-2H-chromen-2-one is a member of coumarins.
Molecule SMILES: CC(=O)NC1C(O)OC(CO)C(OC2OC(CO)C(OC3OC(COC4OC(COC5OC(CO)C(O)C(O)C5O)C(O)C(OC5OC(CO)C(O)C(O)C5O)C4O)C(O)C(OC4OC(CO)C(OC5OC(CO)C(OC6OC(CO)C(O)C(O)C6O)C(O)C5NC(C)=O)C(O)C4OC4OC(CO)C(OC5OC(COC6(C(=O)O)CC(O)C(NC(C)=O)C(C(O)C(O)CO)O6)C(O)C(O)C5O)C(O)C4NC(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: Please give me some details about this molecule <molecule_2d> .

assistant: (2R,4S,5R,6R)-5-Acetamido-2-[[(2R,3R,4S,5R,6S)-6-[(2R,3S,4R,5R,6S)-5-acetamido-6-[(2R,3S,4S,5S,6R)-2-[(2S,3S,4S,5R,6R)-2-[(2R,3S,4R,5R,6S)-5-acetamido-6-[(2R,3S,4R,5R,6R)-5-acetamido-4,6-dihydroxy-2-(hydroxymethyl)oxan-3-yl]oxy-4-hydroxy-2-(hydroxymethyl)oxan-3-yl]oxy-6-[[(2S,3S,4S,5R,6R)-3,5-dihydroxy-4-[(2S,3S,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-6-[[(2S,3S,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]oxan-2-yl]oxymethyl]-3,5-dihydroxyoxan-4-yl]oxy-5-[(2S,3R,4R,5S,6R)-3-acetamido-4-hydroxy-6-(hydroxymethyl)-5-[(2S,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-4-hydroxy-6-(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 carbohydrates and carbohydrate derivatives.
Molecule SMILES: O=C(NCC(c1ccc(F)cc1)N1CCOCC1)c1ccc(Br)o1

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: 5-bromo-N-[2-(4-fluorophenyl)-2-(4-morpholinyl)ethyl]-2-furancarboxamide is an aromatic amide and a heteroarene.