IDEA-AI4S/PubChemSFT huggingface dataset:
Molecule SMILES: CCCCCCCCCCCCCC(=O)CC(C)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: Given the molecule <molecule_2d>, what can you tell me about it?

assistant: Lichesterylic acid is a long-chain fatty acid.
Molecule SMILES: CC(=O)OCC1OC(Oc2cc(C(C)C)c(OC(C)=O)cc2C)C(OC(C)=O)C(OC(C)=O)C1OC(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,3S,4R,5S,6R)-3,4,5-triacetyloxy-6-(4-acetyloxy-2-methyl-5-propan-2-ylphenoxy)oxan-2-yl]methyl acetate is a natural product found in Sphaeranthus suaveolens with data available.
Molecule SMILES: CC(=O)NC1C(OC2C(O)C(COP(=O)(O)OCC3OC(OC4C(O)C(COP(=O)(O)OCCCCCN)OC(OC(CO)C(=O)O)C4NC(C)=O)C(NC(C)=O)C(O)C3O)OC(OC(CO)C(=O)O)C2NC(C)=O)OC(CO)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: P-{alpha-D-GlcpNAc-(1->3)-[D-GroA-(2->1)]-alpha-D-GlcpNAc-6-yl}-alpha-D-GlcpNAc-(1->3)-[P-6-[CH2]5NH2]-alpha-D-GlcpNAc-(1->2)-D-GroA is a tetrasaccharide derivative with a dimeric structure in which two 2-O-[N-acetyl-alpha-D-glucosaminyl-(1->3)-N-acetyl-alpha-D-glucosaminyl]-D-glyceric acid units are linked via a phosphodiester bridge, the reducing-end GlcNAc residue also being connected at O-6 to a 5-aminopentyl linker via a further phosphodiester linkage. It is a tetrasaccharide derivative and a carbohydrate phosphate. It is functionally related to a D-glyceric acid.
Molecule SMILES: CCCCCC=CC=CC(=O)NC(C)CC

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-(Butan-2-yl)deca-2,4-dienamide is a natural product found in Piper retrofractum, Piper nigrum, and other organisms with data available.
Molecule SMILES: C1CC2OC3C4CCCN3C3NCCCC23C4C1

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: Nitraramine is a natural product found in Nitraria billardierei and Nitraria schoberi with data available.
Molecule SMILES: C=CC=CC=CC#CC#CC=CC

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: 7-Chloro-2-(4-chlorophenyl)-3-methylquinoline is a natural product found in Carthamus tinctorius with data available.
Molecule SMILES: CN1CCC2(c3cccc4c3NC3N(C)CCC43c3cccc4c3NC3N(C)CCC43c3cccc4c3NC3N(C)CCC43c3cccc4c3NC3N(C)CCC43C34CCN(C)C3Nc3c(C56CCN(C)C5Nc5ccccc56)cccc34)c3ccccc3NC12

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: (3aR,8bR)-5-[(3aR,8bR)-5-[(3aS,8bS)-5-[(3aR,8bR)-5-[(3aR,8bR)-3-methyl-1,2,3a,4-tetrahydropyrrolo[2,3-b]indol-8b-yl]-3-methyl-1,2,3a,4-tetrahydropyrrolo[2,3-b]indol-8b-yl]-3-methyl-1,2,3a,4-tetrahydropyrrolo[2,3-b]indol-8b-yl]-3-methyl-1,2,3a,4-tetrahydropyrrolo[2,3-b]indol-8b-yl]-8b-[(3aR,8bR)-5-[(3aS,8bS)-3-methyl-1,2,3a,4-tetrahydropyrrolo[2,3-b]indol-8b-yl]-3-methyl-1,2,3a,4-tetrahydropyrrolo[2,3-b]indol-8b-yl]-3-methyl-1,2,3a,4-tetrahydropyrrolo[2,3-b]indole is a natural product found in Psychotria milnei with data available.
Molecule SMILES: C=C(CO)c1cc2cc(C(C)=O)c(O)cc2o1

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: beta-Methylene-5-acetyl-6-hydroxy-2-benzofuranethanol is a natural product found in Eutrochium purpureum var. purpureum with data available.
Molecule SMILES: CC(C)CC1NC(=O)C(CCC(=O)O)NC(=O)C2CCCN2C(=O)CNC(=O)C(Cc2ccccc2)NC(=O)C2CCCN2C(=O)C(Cc2c[nH]c3ccccc23)NC1=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: Hymenamide C is a natural product found in Hymeniacidon with data available.
Molecule SMILES: COc1cc(OC)c(C(=O)C=C(O)c2ccccc2)cc1CC=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: 1-[2,4-Dimethoxy-5-(3-methylbut-2-enyl)phenyl]-3-hydroxy-3-phenylprop-2-en-1-one is a natural product found in Pongamia pinnata with data available.
Molecule SMILES: [NH3+]C(Cc1c[nH]c2ccccc12)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: Tell me something about this molecule: <molecule_2d>

assistant: L-tryptophan zwitterion is an L-alpha-amino acid zwitterion obtained by transfer of a proton from the carboxy to the amino group of L-tryptophan; major species at pH 7.3. It is a tryptophan zwitterion and a L-alpha-amino acid zwitterion. It is a tautomer of a L-tryptophan.
Molecule SMILES: [NH3+]C(Cc1c[nH]c2ccccc12)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: L-Tryptophan is a metabolite found in or produced by Saccharomyces cerevisiae.
Molecule SMILES: [NH3+]C(Cc1c[nH]c2ccccc12)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: Tell me something about this molecule: <molecule_2d>

assistant: Tryptophan is a natural product found in Fragaria chiloensis, Trichoderma asperellum, and other organisms with data available.
Molecule SMILES: CCCCCC=CCC=CCCCCCCCC(=O)OC(CCC(C)=CCOc1ccc2ccc(=O)oc2c1)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: <molecule_2d> What do you know about the molecule?

assistant: [(E,3R)-2-hydroxy-2,6-dimethyl-8-(2-oxochromen-7-yl)oxyoct-6-en-3-yl] octadeca-9,12-dienoate is a natural product found in Aegle marmelos with data available.
Molecule SMILES: C=C1C2CCC3C(C2)(C(=O)OCC32C(=O)C=CC(C)(C)C2C=O)C1OC(C)=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: Eriocalyxin E is a natural product found in Isodon eriocalyx with data available.
Molecule SMILES: CC1OC(Oc2c3c(c(OC4OC(CO)C(O)C(O)C4O)c4ccccc24)C=COC3)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 give me a brief overview of this molecule <molecule_2d> ?

assistant: Clarinoside is a naphthopyran that is 1H-naphtho[2,3-c]pyran-5,10-diol in which the hydroxy group at position 5 (furthest from the pyran oxygen) has been converted to the corresponding beta-D-glucoside, while that at position 10 has been converted to the corresponding 6-deoxy-beta-D-glucopyranoside (beta-D-quinovoside). It was isolated from the flowered aerial parts of the annual plant Mitracarpus scaber. It has a role as an anti-inflammatory agent and a plant metabolite. It is a naphthopyran and a beta-D-glucoside.
Molecule SMILES: COc1ccc(NC(=O)N(C)CC2Oc3ccc(NC(=O)CCC(F)(F)F)cc3C(=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: <molecule_2d> The above is a compound. Could you please tell me something about it?

assistant: 4,4,4-trifluoro-N-[(2R,3S)-5-[(2S)-1-hydroxypropan-2-yl]-2-[[[(4-methoxyanilino)-oxomethyl]-methylamino]methyl]-3-methyl-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-8-yl]butanamide is a member of ureas.
Molecule SMILES: COc1ccc2[nH]c3c(c2c1)CCNC31CSC2c3c(OC(C)=O)c(C)c4c(c3C(COC1=O)N1C(O)C3Cc5cc(C)c(OC)c(O)c5C(C21)N3C)OCO4

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: Lurbinectedin is a DNA alkylating agent that has been investigated in the treatment of a variety of cancers, including mesothelioma, chronic lymphocytic leukemia (CLL), breast cancer, and small-cell lung cancer (SCLC). It is a derivative of the marine-derived agent ecteinascidin ([trabectedin]), an anticancer agent found in extracts of the tunicate Ecteinascidia turbinata, with the primary difference being the substitution of the tetrahydroisoquinoline with a tetrahydro β‐carboline that results in increased antitumour activity of lurbinectedin as compared to its predecessor.  On June 15, 2020, the FDA granted accelerated approval and orphan drug designation to lurbinectedin for the treatment of adult patients with metastatic SCLC who have experienced disease progression despite therapy with platinum-based agents. This accelerated approval is based on the rate and duration of therapeutic response observed in ongoing clinical trials and is contingent on the verification of these results in confirmatory trials.
Molecule SMILES: COc1ccc2[nH]c3c(c2c1)CCNC31CSC2c3c(OC(C)=O)c(C)c4c(c3C(COC1=O)N1C(O)C3Cc5cc(C)c(OC)c(O)c5C(C21)N3C)OCO4

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: Lurbinectedin is a synthetic tetrahydropyrrolo [4, 3, 2-de]quinolin-8(1H)-one alkaloid analogue with potential antineoplastic activity. Lurbinectedin covalently binds to residues lying in the minor groove of DNA, which may result in delayed progression through S phase, cell cycle arrest in the G2/M phase and cell death.
Molecule SMILES: COc1ccc2[nH]c3c(c2c1)CCNC31CSC2c3c(OC(C)=O)c(C)c4c(c3C(COC1=O)N1C(O)C3Cc5cc(C)c(OC)c(O)c5C(C21)N3C)OCO4

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: Lurbinectedin is an Alkylating Drug. The mechanism of action of lurbinectedin is as an Alkylating Activity.
Molecule SMILES: COc1ccc2[nH]c3c(c2c1)CCNC31CSC2c3c(OC(C)=O)c(C)c4c(c3C(COC1=O)N1C(O)C3Cc5cc(C)c(OC)c(O)c5C(C21)N3C)OCO4

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: Lurbinectedin is an antineoplastic alkylating agent and synthetic derivative of trabectedin that is used to treat refractory, metastatic small cell lung cancer. Lurbinectedin therapy is associated with a high rate of transient serum enzyme elevations during treatment and with occasional instances of clinically apparent liver injury with jaundice.
Molecule SMILES: COc1ccc2c(c1)OCC(c1cc3c(-c4ccc(O)cc4)cc(-c4ccc(O)cc4OC)oc-3cc1=O)C2

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: Retusapurpurin A is a natural product found in Dalbergia sissoo, Dalbergia parviflora, and other organisms with data available.
Molecule SMILES: COc1cc(C(=O)OC2Cc3c(OC(C)=O)cc(OC(C)=O)cc3OC2c2cc(OC(C)=O)c(OC(C)=O)c(OC(C)=O)c2)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: <molecule_2d> The above is a compound. Could you please tell me something about it?

assistant: [(2R,3R)-5,7-diacetyloxy-2-(3,4,5-triacetyloxyphenyl)-3,4-dihydro-2H-chromen-3-yl] 4-acetyloxy-3-methoxybenzoate is a natural product found in Stryphnodendron adstringens with data available.
Molecule SMILES: C[N+](C)(C)CCOP(=O)([O-])OCC(CO)OC(=O)CCCCCCCC(=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: 2-azelaoyl-sn-glycero-3-phosphocholine(1-) is the conjugate base of 2-azelaoyl-sn-glycero-3-phosphocholine, obtained by deprotonation of the free carboxy group; major species at pH 7.3. It is a conjugate base of a 2-azelaoyl-sn-glycero-3-phosphocholine.
Molecule SMILES: CC=CC(=O)CC1CCC(C)C(CC(=O)NCC(O)C(C)C(=O)NCCCC2OC3(CCCC(CCC(C)C=C(C)C(C)OC(C)=O)O3)CCC2C)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: CID 6440084 is a natural product found in Lissoclinum bistratum with data available.
Molecule SMILES: CN(C)CCCn1c2c(c3ccccc31)CCCCCC2

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: Iprindole is a member of indoles.
Molecule SMILES: CC(=CCl)CC=CCCCCC1CC=CC(=O)O1

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: Coibacin D is a natural product found in Oscillatoria with data available.
Molecule SMILES: CCC(C)C1NC(=O)C(C(C)O)NC(=O)C(Cc2ccc(O)cc2)NC(=O)C(CC(C)C)NC(=O)C(Cc2cnc[nH]2)NC(=O)C(C(C)O)NC(=O)CNC(=O)C2CCCN2C(=O)C(C(C)O)NC1=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: Piricyclamide GTHLYTITP is a natural product found in Microcystis aeruginosa with data available.
Molecule SMILES: CS(=O)CCCCCCC(=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: Tell me something about this molecule: <molecule_2d>

assistant: [3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl] 7-methylsulfinyl-N-sulfooxyheptanimidothioate is a natural product found in Erysimum asperum, Arabidopsis thaliana, and Dithyrea californica with data available.
Molecule SMILES: CCC12CC3C(C)(C(OC(C)=O)c4ccoc4)C(OC(C)=O)C(OC(C)=O)C4(O)C3(O1)C(O2)C1(O)C(OC(C)=O)C2(C)CC1(O)C4(COC(C)=O)C2CC(=O)OC

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: methyl 2-[(1S,2R,3R,5S,7R,8R,9R,10R,11R,12S,13S,14R,16R,17S)-9,10,17-triacetyloxy-8-[(S)-acetyloxy(furan-3-yl)methyl]-12-(acetyloxymethyl)-5-ethyl-1,11,16-trihydroxy-8,14-dimethyl-4,18-dioxahexacyclo[12.2.1.12,5.03,7.03,11.012,16]octadecan-13-yl]acetate is a natural product found in Chukrasia tabularis with data available.
Molecule SMILES: CC(C)CCCC(C)CCCC(C)CCC(=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: S-[2-[3-[[4-[[[5-(6-aminopurin-9-yl)-4-hydroxy-3-phosphonooxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-hydroxyphosphoryl]oxy-2-hydroxy-3,3-dimethylbutanoyl]amino]propanoylamino]ethyl] 4,8,12-trimethyltridecanethioate is a natural product found in Homo sapiens with data available.
Molecule SMILES: CCC=CC=CC1(C)OC(c2ccsc2C)=C(C(=O)OC)C1=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: Thiocarboxylic A is a natural product found in Penicillium with data available.
Molecule SMILES: CC1OC(OC2C(OC3CCC4(C)C(CCC5(C)C4CC=C4C6C7(CCC(C)(OC7=O)C6(C)O)CCC45C)C3(C)C)OCC(O)C2OC2OC(CO)C(O)C(O)C2OC2OC(CO)C(O)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> The above is a compound. Could you please tell me something about it?

assistant: Ilekudinoside G is a natural product found in Ilex kaushue with data available.
Molecule SMILES: CC1=CC2C3C4C(=C(C)C3C13C1OC(=O)C(C)C1CCC(C)(O)C23)C1OC(=O)C(C)C1CCC4(C)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: Absinthin is a dimeric sesquiterpene lactone that is produced by the plant Artemisia absinthium (Wormwood). The bitter tasting constituent of Absinthe. It has a role as a plant metabolite and an anti-inflammatory agent. It is a sesquiterpene lactone, a triterpenoid and an organic heteroheptacyclic compound.
Molecule SMILES: CC1=CC2C3C4C(=C(C)C3C13C1OC(=O)C(C)C1CCC(C)(O)C23)C1OC(=O)C(C)C1CCC4(C)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: Absinthin is a natural product found in Artemisia genipi, Artemisia annua, and other organisms with data available.
Molecule SMILES: O=P(O)(O)OC1OC(CF)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: Describe this molecule: <molecule_2d> .

assistant: [(2R,3R,4S,5S)-5-(fluoromethyl)-3,4-dihydroxyoxolan-2-yl] dihydrogen phosphate is a natural product found in Streptomyces cattleya with data available.
Molecule SMILES: CCCCCCC(C)C1CC(=O)NC(C(C)C)C(=O)NC(Cc2ccccc2)C(=O)NC(C(C)CC)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: Could you provide a description of this molecule <molecule_2d> ?

assistant: cyclo[D-Ile-Unk-D-Val-D-Phe] is a natural product found in Beauveria bassiana with data available.
Molecule SMILES: CCC(=O)NC1CCC(CCNC(=O)Nc2ccc(C(F)(F)F)cc2)OC1CO

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-[(2S,3S,6R)-2-(hydroxymethyl)-6-[2-[[oxo-[4-(trifluoromethyl)anilino]methyl]amino]ethyl]-3-oxanyl]propanamide is a C-glycosyl compound.
Molecule SMILES: CCCCCC=CCC=CCCCCCCCCCC(=O)OC(CC(=O)O)C[N+](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: Please give me some details about this molecule <molecule_2d> .

assistant: ACar 20:2 is an O-acylcarnitine.
Molecule SMILES: COC1C(OCC2C=CCCC(=O)C(C)(O)CC(C)C(OC3OC(C)CC(O)(C(C)O)C3O)C(C)C=CC(=O)OC2C)OC(C)C(O)C1OC

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: Aldgamycin N is a natural product found in Streptomyces with data available.
Molecule SMILES: CC(C)(C)CC(C)(C)c1ccc(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: alpha-(p-(1,1,3,3-Tetramethylbutyl)phenyl)-omega-hydroxypoly(oxyethylene) is used as a food additive [EAFUS] (EAFUS: Everything Added to Food in the United States. [http://www.eafus.com/]).

alpha-(p-(1,1,3,3-Tetramethylbutyl)phenyl)-omega-hydroxypoly(oxyethylene) belongs to the family of p-Menthane Monoterpenes. These are monoterpenes whose structure is based on the p-menthane backbone.
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: Describe this molecule: <molecule_2d> .

assistant: Quercetin 3-O-alpha-rhamnopyranosyl-(1-2)-beta-galactopyranoside is a natural product found in Prunus mume, Lysimachia nummularia, and other organisms with data available.
Molecule SMILES: CC(C)NCCCn1c(Sc2cc3c(cc2I)OCO3)nc2c(N)ncnc21

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: Zelavespib (PU-H71) has been used in trials studying the treatment of LYMPHOMA, Solid Tumors, Metastatic Solid Tumor, and Myeloproliferative Neoplasms (MPN).
Molecule SMILES: CC(C)NCCCn1c(Sc2cc3c(cc2I)OCO3)nc2c(N)ncnc21

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: Zelavespib is a purine-based heat shock protein 90 (Hsp90) inhibitor with potential antineoplastic activity. Zelavespib specifically inhibits active Hsp90, thereby inhibiting its chaperone function and promoting the proteasomal degradation of oncogenic signaling proteins involved in tumor cell proliferation and survival. This may result in the inhibition of cellular proliferation in susceptible tumor cell populations. Hsp90, a molecular chaperone protein, is upregulated in a variety of tumor cell types.
Molecule SMILES: CCc1cc(C(=O)c2ccc(C)cc2)c(NC(=O)CCl)s1

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: 2-chloro-N-[5-ethyl-3-[(4-methylphenyl)-oxomethyl]-2-thiophenyl]acetamide is an aromatic ketone.
Molecule SMILES: CC(C)(Sc1ccncc1-c1ccc(C#N)c2ccccc12)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: Verinurad has been used in trials studying the basic science and treatment of Gout, Gout and Hyperuricemia, and Gout and Asymptomatic Hyperuricemia.
Molecule SMILES: CCCC(=O)OC1CCC(C)=CC2OC(=O)C(C)C2(O)C(OC(C)=O)C2C(C)=CCC(OC(C)=O)C12C

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: Renillin C is a natural product found in Renilla reniformis with data available.
Molecule SMILES: C1=CCCC23CN4CCCCC=CCCC5(OC5C(c5nccc6c5[nH]c5ccccc56)C2CC4)C3NCCCC1

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: Manzamine B is a natural product found in Amphimedon, Ircinia, and Haliclona with data available.
Molecule SMILES: C=CC1(C)C=C2C(=O)c3c(NC=O)cccc3C(C)(C)C2CC1Cl

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: Fontonamide is a natural product found in Fischerella muscicola with data available.
Molecule SMILES: CCC=CCC(=O)C=CC=CC=CC=CC(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: 17-oxoresolvin D1(1-) is a polyunsaturated fatty acid that is the conjugate base of 17-oxoresolvin D1, obtained by deprotonation of the carboxy group; major species at pH 7.3. It is a polyunsaturated fatty acid anion, a long-chain fatty acid anion, a hydroxy fatty acid anion and an oxo fatty acid anion. It is a conjugate base of a 17-oxoresolvin D1.