IDEA-AI4S/PubChemSFT huggingface dataset:
Molecule SMILES: CCCCC(O)C=CC(O)CC=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: (2Z,5R,6Z,8R)-5,8-dihydroxydodeca-2,6-dienoic acid is a natural product found in Aeollanthus buchnerianus with data available.
Molecule SMILES: CCC(C(=O)C(C)C(O)C(C)C1OC(O)(CC)C(C)CC1C)C1OC(C)(C2(O)OC(CC)(C(C)O)CC2C)CC1C

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: (3R,5S,6S,7S)-7-[(2S,3S,5R,6S)-6-ethyl-6-hydroxy-3,5-dimethyloxan-2-yl]-3-[(2S,3S,5S)-5-[(2R,3R,5R)-5-ethyl-2-hydroxy-5-[(1R)-1-hydroxyethyl]-3-methyloxolan-2-yl]-3,5-dimethyloxolan-2-yl]-6-hydroxy-5-methyloctan-4-one is a natural product found in Streptomyces with data available.
Molecule SMILES: CCCCOC(=O)c1c(O)cc(C)cc1Oc1c(OC)cc(O)cc1C(=O)OC

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: Butyl Asterrate is a natural product found in Geomyces with data available.
Molecule SMILES: C=C(C)C1COc2c(C)cc3oc4c(CC(O)C(C)(C)OCc5c(C=CC(O)C(O)C=CC)cccc5OC)ccc(O)c4c(=O)c3c2C1O

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: 8-[3-[[2-(3,4-dihydroxyhepta-1,5-dienyl)-6-methoxyphenyl]methoxy]-2-hydroxy-3-methylbutyl]-1,11-dihydroxy-5-methyl-2-prop-1-en-2-yl-2,3-dihydro-1H-pyrano[3,2-a]xanthen-12-one is a natural product found in Aspergillus with data available.
Molecule SMILES: [SnH3+]

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: Stannylium is a tin hydride.
Molecule SMILES: COC(=O)C(C)=C1C(=O)C(O)C2(C)C3=C(C(O)C4C5(OC(=O)C6=C5CC5C(O)(COC(=O)C(C)=CCOC(=O)CCC(=O)OC6)C6CC6C54C)C13)C1CC12

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: Chloramultiol A is a natural product found in Chloranthus multistachys with data available.
Molecule SMILES: CC(C)CCCCCCCCCCCCCCCCCCCCCCCCCC(=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: 27-Methyl octacosanoic acid is a natural product found in Petrosia pellasarca with data available.
Molecule SMILES: CCCCCCCCCCCCCCCCC(C)(O)CC1(C)OC(=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 provide a description of this molecule <molecule_2d> ?

assistant: (4S,5S)-4-hydroxy-5-[(2R)-2-hydroxy-2-methyloctadecyl]-5-methyloxolan-2-one is a natural product found in Plakortis halichondrioides with data available.
Molecule SMILES: CC(C)(O)C1CCC(C)(C2C(O)CC3(C)C4CC(OC5OCC(O)C(O)C5O)C5C(C)(C)C(OC6OCC(O)C(OC7OC(CO)C(O)C(O)C7O)C6O)CCC56CC46CCC23C)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> What do you know about the molecule?

assistant: (2S,3R,4S,5S,6R)-2-[(2S,3R,4S,5R)-3,5-dihydroxy-2-[[(1S,3R,6S,8R,9S,11S,12S,14S,15R,16R)-14-hydroxy-15-[(2R,5S)-5-(2-hydroxypropan-2-yl)-2-methyloxolan-2-yl]-7,7,12,16-tetramethyl-9-[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxy-6-pentacyclo[9.7.0.01,3.03,8.012,16]octadecanyl]oxy]oxan-4-yl]oxy-6-(hydroxymethyl)oxane-3,4,5-triol is a natural product found in Astragalus caspicus with data available.
Molecule SMILES: CC(C)CC=CC(C)C1CCC2C3CC(O)C4=CC(=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: Describe this molecule: <molecule_2d> .

assistant: (6S,8S,9S,10R,13R,14S,17R)-6-hydroxy-10,13-dimethyl-17-[(E,2S)-6-methylhept-3-en-2-yl]-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-one is a natural product found in Hypnea musciformis with data available.
Molecule SMILES: CC1C(NC(=O)C(=NOC(C)(C)C(=O)O)c2csc(N)n2)C(=O)N1S(=O)(=O)O.NCCCCC(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> What do you know about the molecule?

assistant: Aztreonam Lysine is a formulation of the synthetic monobactam antibiotic, aztreonam and lysine used in an inhaled form for the treatment of chronic airway infections by Pseudomonas aeruginosa in patients with cystic fibrosis.
Molecule SMILES: CC(C)(O)C1CCC(C2C(O)CC3(C)C4=CCC5C(C)(C)C(=O)CCC5(C)C4CCC23C)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: Describe this molecule: <molecule_2d> .

assistant: (3R,6S)-3-[(5R,9R,10R,13S,14S,16S,17S)-16-hydroxy-4,4,10,13,14-pentamethyl-3-oxo-1,2,5,6,9,11,12,15,16,17-decahydrocyclopenta[a]phenanthren-17-yl]-6-(2-hydroxypropan-2-yl)oxan-2-one is a natural product found in Melia azedarach with data available.
Molecule SMILES: COc1ccc2c(c1O)OCC1c3ccc(OC)c(OC)c3OC21

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: (6aS,11aR)-3,9,10-trimethoxy-6a,11a-dihydro-6H-[1]benzofuro[3,2-c]chromen-4-ol is a natural product found in Dalbergia odorifera with data available.
Molecule SMILES: CC1CN(C(C)CO)C(=O)CCCn2cc(nn2)COC1CN(C)C(=O)c1ccc(N2CCN(C)CC2)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 description of this molecule <molecule_2d> .

assistant: N-[[(8R,9R)-6-[(2S)-1-hydroxypropan-2-yl]-8-methyl-5-oxo-10-oxa-1,6,13,14-tetrazabicyclo[10.2.1]pentadeca-12(15),13-dien-9-yl]methyl]-N-methyl-4-(4-methyl-1-piperazinyl)benzamide is an azamacrocycle and a lactam.
Molecule SMILES: COc1cc(-c2oc3cc(O)cc(O)c3c(=O)c2OC2OC(COC3OC(C)C(O)C(O)C3O)C(OC3OC(CO)C(O)C(O)C3O)C(O)C2O)ccc1O

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-[(2S,3R,4R,5S,6R)-3,4-dihydroxy-5-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-6-[[(2R,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxymethyl]oxan-2-yl]oxy-5,7-dihydroxy-2-(4-hydroxy-3-methoxyphenyl)chromen-4-one is a natural product found in Opuntia ficus-indica with data available.
Molecule SMILES: Nc1ccc(C(=O)[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: 4-aminobenzoate is an aromatic amino-acid anion that is the conjugate base of 4-aminobenzoic acid. It has a role as an Escherichia coli metabolite, a plant metabolite and a Saccharomyces cerevisiae metabolite. It is an aromatic amino-acid anion and an aminobenzoate. It is functionally related to a benzoate. It is a conjugate base of a 4-aminobenzoic acid.
Molecule SMILES: COC1CN(C)C(=O)c2cc(NS(=O)(=O)c3cccc(F)c3)ccc2OCC(C)N(C(=O)Cc2cccnc2)CC1C

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: 3-fluoro-N-[(4S,7S,8S)-8-methoxy-4,7,10-trimethyl-11-oxo-5-[1-oxo-2-(3-pyridinyl)ethyl]-2-oxa-5,10-diazabicyclo[10.4.0]hexadeca-1(12),13,15-trien-14-yl]benzenesulfonamide is a lactam and an azamacrocycle.
Molecule SMILES: CC(C)(O)CCCC(CCC(O)C(C)(C)O)C1CCC2C(=CC=C3CC(O)CC(O)C3)CCCC21C

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: (20R)-24-Hydroxy-19-norgeminivitamin D3 is a vitamin D.
Molecule SMILES: Nc1cccc(-c2ncccn2)c1

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: 3-Pyrimidin-2-ylaniline is a substituted aniline.
Molecule SMILES: Cc1cc2cc(CNC(=O)Cc3ccc([N+](=O)[O-])cc3)ccc2n1C

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: N-[(1,2-dimethyl-5-indolyl)methyl]-2-(4-nitrophenyl)acetamide is a member of indoles.
Molecule SMILES: COC1=CC(=O)C=C(OC)C1(O)CC(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: 2,6-Dimethoxy-1-acetonylquinol is a natural product found in Pentaclethra eetveldeana, Rhinacanthus nasutus, and other organisms with data available.
Molecule SMILES: C=C1C(=O)C23C(O)CC4C5(C)CCC(O)C4(C(O)OC5)C2CCC1C3O

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,2S,5S,8R,9R,11R,12R,15R,16S,19R)-9,15,16,19-tetrahydroxy-12-methyl-6-methylidene-14-oxapentacyclo[10.3.3.15,8.01,11.02,8]nonadecan-7-one is a natural product found in Isodon inflexus with data available.
Molecule SMILES: c1cncc(C2=NC(CN3CCCCC3)CON2)c1

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: BRX-235 (iroxanadine) is a a novel small molecule synthesized by Biorex, Hungary that acts as a cardioprotective agent. It induces phosphorylation of p38 SAPK, which plays an important role in EC homeostasis. endothelial cell (EC). EC function plays a central role in vascular diseases (e.g. atherosclerosis, restenosis, diabetic angiopathies, microvascular angina, peripheral arterial disease). BRX-235 also causes translocation of calcium-dependent protein kinase C isoform to membranes.
Molecule SMILES: OCC(O)C1OC(OC(CO)C2OC(OC(CO)C3OC(OC(CO)C4OC(O)C(O)C4O)C(O)C3O)C(O)C2O)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: Beta-D-Galf-(1->5)-beta-D-Galf-(1->5)-beta-D-Galf-(1->5)-beta-D-Galf is a galactotetraose composed of four beta-D-galactofuranose units joined by (1->5)-linkages.
Molecule SMILES: Cc1occc1SSc1ccoc1C

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: Bis(2-methyl-3-furyl)disulfide is a member of the class of furans that is disulfane in which both hydrogen's are substituted by 2-methylfuran-3-yl groups. It is a flavouring agent found in meat. It has a role as a human metabolite, a flavouring agent, a plant metabolite, a mammalian metabolite and a Maillard reaction product. It is a member of furans and an organic disulfide.
Molecule SMILES: Cc1occc1SSc1ccoc1C

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: bis-(2-methyl-3-furyl) disulfide is a metabolite found in or produced by Saccharomyces cerevisiae.
Molecule SMILES: Cc1occc1SSc1ccoc1C

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: 3,3'-Dithiobis[2-methylfuran] is a metabolite found in or produced by Saccharomyces cerevisiae.
Molecule SMILES: COC1C=CC(C)C(C(C)C(OC)C(C)CCC(=O)C(C)C(CC=CN(C)C=O)OC)OC(=O)C=CC=C(C)CC(OC)CC2=CC(=O)OC(C2O)C(C)C(OC)CC(OC)C=CC(C)C(O)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> The above is a compound. Could you please tell me something about it?

assistant: Sphinxolide B is a natural product found in Reidispongia coerulea with data available.
Molecule SMILES: O.O.O.O.[OH3+].[OH3+].[Pt]

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: Diaquatetrahydroxidoplatinum is a platinum coordination entity.
Molecule SMILES: CC1=C2C(=O)NC1C=CC(C)(O)CCC1C(CC(C)C2=O)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: I'd like a short overview about this molecule <molecule_2d>. Can you do that?

assistant: (3R,5R,7S,10S,11E,13S)-10-hydroxy-3,6,6,10,16-pentamethyl-14-azatricyclo[11.2.1.05,7]hexadeca-1(16),11-diene-2,15-dione is a natural product found in Jatropha curcas with data available.
Molecule SMILES: Cc1noc(C)c1NC(=O)Nc1ccc2c(c1)C(=O)N(C(C)CO)CC(C)C(CN(C)Cc1ccc(Oc3ccccc3)cc1)O2

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-(3,5-dimethyl-4-isoxazolyl)-3-[(2S,3R)-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-2-[[methyl-[(4-phenoxyphenyl)methyl]amino]methyl]-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-8-yl]urea is an aromatic ether.
Molecule SMILES: CC1=CC2OOC1CC2C(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: (1S,4R,7R)-5-Methyl-7-isopropyl-2,3-dioxabicyclo[2.2.2]oct-5-ene is a natural product found in Callilepis laureola with data available.
Molecule SMILES: O=C(COc1ccc2c3c(c(=O)oc2c1)CCC3)NC1CCCCC1

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

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

assistant: N-cyclohexyl-2-[(4-oxo-2,3-dihydro-1H-cyclopenta[c][1]benzopyran-7-yl)oxy]acetamide is a member of coumarins.
Molecule SMILES: CC(=O)OCC1=COC(OC(=O)CC(C)C)C2C1=CC(OC(=O)CC(C)(C)OC(C)=O)C2(O)CCl

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: Valeriandoid B is a natural product found in Valeriana jatamansi with data available.
Molecule SMILES: CONCCCCCCCCCCC(C)Cc1cccnc1

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: Hachijodine D is a natural product found in Amphimedon and Xestospongia with data available.
Molecule SMILES: CCCCCCCCCCCCCCCCC(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: <molecule_2d> What do you know about the molecule?

assistant: 2-hydroxyoctadecanoic acid is a long-chain fatty acid that is stearic (octadecanoic) acid substituted at position 2 by a hydroxy group. It has a role as a human metabolite. It is a 2-hydroxy fatty acid and a hydroxyoctadecanoic acid. It is a conjugate acid of a 2-hydroxyoctadecanoate.
Molecule SMILES: CCCCCCCCCCCCCCCCC(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: <molecule_2d> What do you know about the molecule?

assistant: 2-Hydroxyoctadecanoic acid is a natural product found in Aplysina fistularis, Aplysina lacunosa, and other organisms with data available.
Molecule SMILES: CC1CN(C(C)CO)C(=O)c2ccccc2-c2ccccc2COC1CN(C)C(=O)NC1CCCCC1

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

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

assistant: LSM-14575 is a benzenoid aromatic compound.
Molecule SMILES: COC(=O)C(C)=CC1CC(C)C2(C)C(C=C3C4=C(CCC32C)C2(C)CCC(O)C(C)(C)C2CC4)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: methyl (E)-3-[(4R,6R,8R,9S,10R,14S,17R,19R)-17-hydroxy-8,9,10,14,18,18-hexamethyl-5-oxapentacyclo[11.8.0.02,10.04,9.014,19]henicosa-1(13),2-dien-6-yl]-2-methylprop-2-enoate is a natural product found in Garcinia speciosa and Garcinia celebica with data available.
Molecule SMILES: COC(C=CC(C)=CC=CC(C)=C1C(=O)CC2C1(C)CCC1C2(C)CCC(OC(C)=O)C1(C)C(=O)[O-])C(C)(C)O

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

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

assistant: Globostellatate C(1-) is an oxo monocarboxylic acid anion obtained by the deprotonation of the carboxylic group of globostellatic acid C. It is a conjugate base of a globostellatic acid C.
Molecule SMILES: COc1cc2oc(-c3ccc(O)c(O)c3)c(OC3OC(C(=O)O)C(O)C(O)C3OC3OC(CO)C(O)C(O)C3OC(=O)C=Cc3ccc(O)c(O)c3)c(=O)c2c(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: (2R,3S,4S,5R,6S)-6-[2-(3,4-dihydroxyphenyl)-5,6-dihydroxy-7-methoxy-4-oxochromen-3-yl]oxy-5-[(2S,3R,4S,5S,6R)-3-[(E)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxy-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3,4-dihydroxyoxane-2-carboxylic acid is a natural product found in Paepalanthus latipes with data available.
Molecule SMILES: CCC(C)CC1(C)C=CC(=C2C(=O)OC(CC(=O)O)C2=O)O1

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: Nodulisporacid A is a natural product found in Nodulisporium with data available.
Molecule SMILES: COc1cc(C=CC(=O)OCCOC(C)=O)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: Tell me something about this molecule: <molecule_2d>

assistant: 2-Acetyloxyethyl 3-(3,4,5-trimethoxyphenyl)prop-2-enoate is a natural product found in Oxalis pes-caprae with data available.
Molecule SMILES: CC1=CCC(C(C)C)C=CC(C)(O)CC=CC2(C)CCC1O2

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

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

assistant: (1R,2E,5S,6E,8S,10E,12S)-1,5,11-trimethyl-8-propan-2-yl-15-oxabicyclo[10.2.1]pentadeca-2,6,10-trien-5-ol is a natural product found in Nicotiana tabacum with data available.
Molecule SMILES: C=C1C(=O)OC2C3C(C)=CCC3=C(C)C(OC(C)=O)C(OC(=O)C3(C)OC3C)C12

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

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

assistant: [(3aS,4R,5R,9aS,9bR)-5-acetyloxy-6,9-dimethyl-3-methylidene-2-oxo-3a,4,5,7,9a,9b-hexahydroazuleno[4,5-b]furan-4-yl] (2S,3R)-2,3-dimethyloxirane-2-carboxylate is a natural product found in Heliopsis helianthoides with data available.
Molecule SMILES: CC(C=CC(=O)O)=CCC(O)C(C)C(O)C=CC=CC=CC1C(C)=CC2C(C1C=C1C=CC(=O)C=C1)C(C)(C)CC2(C)O

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

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

assistant: Elansolid A3 is a natural product found in Chitinophaga sancti with data available.
Molecule SMILES: CN1CCN(Cc2ccc(Nc3ncc(Cl)c(Nc4ccccc4S(=O)(=O)N(C)C)n3)cc2)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: Dubermatinib is under investigation in clinical trial NCT03572634 (Phase 1/2 Study of TP-0903 (an Inhibitor of AXL Kinase) in Patients With Previously Treated CLL).
Molecule SMILES: CN1CCN(Cc2ccc(Nc3ncc(Cl)c(Nc4ccccc4S(=O)(=O)N(C)C)n3)cc2)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: Dubermatinib is an orally available and selective inhibitor of the receptor tyrosine kinase AXL (UFO), with potential antineoplastic activity. Upon administration, dubermatinib targets and binds to AXL and prevents its activity. This blocks AXL-mediated signal transduction pathways and inhibits the epithelial-mesenchymal transition (EMT), which, in turn, inhibits tumor cell proliferation and migration. In addition, TP-0903 enhances chemo-sensitivity to certain other chemotherapeutic agents. AXL, a member of the Tyro3, AXL and Mer (TAM) family of receptor tyrosine kinases and overexpressed by many tumor cell types, plays a key role in tumor cell proliferation, survival, invasion and metastasis; its expression is associated with drug resistance and poor prognosis.
Molecule SMILES: CN1CCN(Cc2ccc(Nc3ncc(Cl)c(Nc4ccccc4S(=O)(=O)N(C)C)n3)cc2)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: 2-((5-chloro-2-((4-((4-methylpiperazin-1-yl)methyl)phenyl)amino)pyrimidin-4-yl)amino)-N,N-dimethylbenzenesulfonamide is a natural product found in Dracaena angustifolia with data available.
Molecule SMILES: CC1=C2N=C(C=C3N=C(C(C)=C4[N-]C(C(CC(N)=O)C4(C)CCC(=O)NCC(C)OP(=O)([O-])OC4C(CO)OC(n5cnc6cc(C)c(C)cc65)C4O)C4(C)N=C1C(CCC(N)=O)C4(C)CC(N)=O)C(CCC(N)=O)C3(C)C)C(CCC(N)=O)C2(C)CC(N)=O.[C-]#N.[Co+3]

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: Cyanocobalamin is a cobalt-containing coordination compound generated by intestinal microbes, and a natural water-soluble vitamin of the B-complex family that must combine with Intrinsic Factor for absorption by the intestine. Cyanocobalamin is necessary for hematopoiesis, neural metabolism, DNA and RNA production, and carbohydrate, fat, and protein metabolism. B12 improves iron functions in the metabolic cycle and assists folic acid in choline synthesis. B12 metabolism is interconnected with that of folic acid. Vitamin B12 deficiency causes pernicious anemia, megaloblastic anemia, and neurologic lesions.
Molecule SMILES: O=C1OC2C(COC(=O)c3cc(O)c(O)c(O)c3)OC(OC(=O)c3cc(O)c(O)c(O)c3)C(OC(=O)c3cc(O)c(O)c4c3C3C1=CC(=O)C(O)(O)C3(O)O4)C2OC(=O)c1cc(O)c(O)c(O)c1

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: Terchebin is a natural product found in Macaranga tanarius, Euphorbia maculata, and other organisms with data available.
Molecule SMILES: C=CC(C)(C)c1[nH]c2ccccc2c1C=C1NC(=O)C2(CC(CCc3c(O)cc(CC=C(C)C)c(O)c3C=O)C=CC2C)NC1=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: (+)-eurotinoid B is a natural product found in Eurotium with data available.