IDEA-AI4S/PubChemSFT huggingface dataset:
Molecule SMILES: [C-]#[N+]C1C2C(CCC1(C)O)C(C)([N+]#[C-])CCC2C1(C)CCC(C(=C)C)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: 1,5-Diisocyano-2,5-dimethyl-8-(2-methyl-5-prop-1-en-2-yloxolan-2-yl)-1,3,4,4a,6,7,8,8a-octahydronaphthalen-2-ol is a natural product found in Acanthella pulcherrima with data available.
Molecule SMILES: C=C1CC2CCC34CC5OC6C(OC7CCC(CC(=O)OC8C(CC9OC(CCC1O2)CC(C)C9=C)OC1CC2OC9(CC2OC1C8C)CC1OC2(CC(C)C8OC(C(O)CC(O)CO)CC8O2)CC(C)C1O9)OC7C6O3)C5O4

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: Halichondrin B is a complex macrolide polyether from marine sponge genera, such as Halichondria, Axinella, Phakellia, and Lissodendoryx that binds to tubulin, thereby inhibiting mitosis. (NCI)
Molecule SMILES: C=C1CC2CCC34CC5OC6C(OC7CCC(CC(=O)OC8C(CC9OC(CCC1O2)CC(C)C9=C)OC1CC2OC9(CC2OC1C8C)CC1OC2(CC(C)C8OC(C(O)CC(O)CO)CC8O2)CC(C)C1O9)OC7C6O3)C5O4

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

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

assistant: CID 135875334 is a natural product found in Axinella, Halichondria okadai, and other organisms with data available.
Molecule SMILES: CCCCCCCCCCCCCCCC(=O)NC(COP(=O)(O)OCCN)C(O)CCCCCCCCCCCCCCC

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-hexadecanoylsphinganine-1-phosphoethanolamine is an N-acylsphinganine-1-phosphoethanolamine in which the N-acyl group is specified as hexadecanoyl. It is functionally related to a hexadecanoic acid. It is a tautomer of a N-hexadecanoylsphinganine-1-phosphoethanolamine zwitterion.
Molecule SMILES: CC(C)=CCCC(C)=CCOc1cc(O)c(C(=O)C(C)C)c(O)c1C

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: Adotogirin is a natural product found in Hypericum erectum with data available.
Molecule SMILES: O=C(O)c1c(O)ccc(Cc2cc(O)ccc2OC2OC(CO)C(O)C(O)C2O)c1O

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

user: Could you provide a description of this molecule <molecule_2d> ?

assistant: 2,6-Dihydroxy-3-[[5-hydroxy-2-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]methyl]benzoic acid is a natural product found in Alangium platanifolium with data available.
Molecule SMILES: CC1CN(C(C)CO)S(=O)(=O)c2ccc(C3=CCCCC3)cc2OC1CN(C)C(=O)Cc1ccccc1

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-[[(4R,5R)-8-(1-cyclohexenyl)-2-[(2R)-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-phenylacetamide is a member of acetamides.
Molecule SMILES: 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(=CCC4C5(C)CCC(OC6OCC(O)C(O)C6OC6OC(C)C(O)C(O)C6O)C(C)(C)C5CCC43C)C2C1

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: Yemuoside YM10 is a natural product found in Eleutherococcus senticosus with data available.
Molecule SMILES: CC(=O)C1OC(=O)C(C)C(OC2OC(C)CC([N+](C)(C)[O-])C2O)C(C)CC(C)C(=O)C=CC1C

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: 12-ketomethymycin N-oxide is a macrolide that is the N-oxide of 12-ketomethymycin. It is a natural product synthesized by Streptomyces sp. AM4900 without biological activity. It has a role as a bacterial metabolite. It is an enone, a macrolide, a monosaccharide derivative, a N-oxide and a zwitterion. It is functionally related to a 12-ketomethymycin.
Molecule SMILES: COc1cc(C(=O)OC2CC(C)(O)C=CC3(C)CCC(O)(C(C)C)C23)ccc1O

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: [(3R,3aS,4S,6R,8aS)-3,6-dihydroxy-6,8a-dimethyl-3-propan-2-yl-2,3a,4,5-tetrahydro-1H-azulen-4-yl] 4-hydroxy-3-methoxybenzoate is a natural product found in Ferula kuhistanica with data available.
Molecule SMILES: COC1CN(C)C(=O)c2ccc(NC(=O)C3CCOCC3)cc2OCC(C)N(Cc2nccs2)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: N-[(5S,6R,9S)-5-methoxy-3,6,9-trimethyl-2-oxo-8-(2-thiazolylmethyl)-11-oxa-3,8-diazabicyclo[10.4.0]hexadeca-1(12),13,15-trien-14-yl]-4-oxanecarboxamide is an azamacrocycle and a lactam.
Molecule SMILES: CCC(C)C(NC(=O)NC1CCCCNC(=O)C(Cc2ccccc2)NC(=O)C(CC(N)=O)N(C)C(=O)C(CCCCc2ccccc2)NC(=O)C(C(C)CC)NC1=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: Describe this molecule: <molecule_2d> .

assistant: Anabaenopeptin SA8 is a natural product found in Nostoc calcicola with data available.
Molecule SMILES: CC(C)C#Cc1ccc(C2C(CO)N3C(=O)CN(C(=O)Cc4ccccc4)CC23)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: (6R,7R,8S)-8-(hydroxymethyl)-7-[4-(3-methylbut-1-ynyl)phenyl]-4-(1-oxo-2-phenylethyl)-1,4-diazabicyclo[4.2.0]octan-2-one is a ring assembly, a member of azetidines and a member of benzenes.
Molecule SMILES: Cc1ncsc1CCOC(=O)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: Colletotricole A is a natural product found in Colletotrichum gloeosporioides with data available.
Molecule SMILES: CN1C(=CC=Cc2cc[n+](CCC[N+](C)(C)CCC[N+](C)(C)CCC[n+]3ccc(C=CC=C4Sc5ccccc5N4C)cc3)cc2)Sc2ccccc21

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: BoBo-3(4+) is the cationic form of BoBo-3, a symmetrical cyanine dye. It has a role as a fluorochrome. It is a cyanine dye and an organic cation.
Molecule SMILES: CC=CS(=O)CC(NC=C1OCC(O)C(O)C1O)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: N-Fructosyl alliin-H2O is an alpha-amino acid.
Molecule SMILES: COC(=O)C1=CCCC(C)=CC2OCC(C)=C2CC(O)C(C)=CCC1

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: Sarcoglaucol is a natural product found in Sarcophyton cherbonnieri with data available.
Molecule SMILES: FC(F)(F)c1ccc(Cl)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: P-chlorobenzotrifluoride is a clear colorless liquid with an aromatic odor. (NTP, 1992)
Molecule SMILES: COC1=C(Br)C(O)C2(C=C1Br)CC(C(=O)NCCCOc1c(Br)cc(CC[N+](C)(C)C)cc1Br)=NO2

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: Purealidine B is a natural product found in Pseudoceratina verrucosa with data available.
Molecule SMILES: CC1=CCCC2(C)OC2C(=O)c2c(C)coc2C1

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: (1aS,10aR,E)-1a,5,9-Trimethyl-2,3,6,10a-tetrahydrooxireno[2',3':4,5]cyclodeca[1,2-b]furan-10(1aH)-one is a natural product found in Curcuma aromatica, Curcuma kwangsiensis, and other organisms with data available.
Molecule SMILES: COc1cc2c(ccc3cc(O)cc(OC)c32)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: 3,5-Dimethoxy-2,7-phenanthrenediol is a natural product found in Bulbophyllum vaginatum, Pseudomonas cichorii, and other organisms with data available.
Molecule SMILES: C=C1COC2(CC1O)OC1CC3C4CC=C5CC(O)CC(OC6OCC(OS(=O)(=O)O)C(O)C6OC6OC(C)C(O)C(O)C6O)C5(C)C4CCC3(C)C1C2C

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

user: Could you provide a description of this molecule <molecule_2d> ?

assistant: [(3S,4R,5R,6S)-6-[(1S,2S,4S,4'R,6R,7S,8R,9S,12S,13R,14R,16R)-4',16-dihydroxy-7,9,13-trimethyl-5'-methylidenespiro[5-oxapentacyclo[10.8.0.02,9.04,8.013,18]icos-18-ene-6,2'-oxane]-14-yl]oxy-4-hydroxy-5-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-3-yl] hydrogen sulfate is a natural product found in Dracaena angustifolia with data available.
Molecule SMILES: C=C(C)C(O)Cc1c(O)c(CC=C(C)C)c(O)c2c(=O)c(-c3ccc(OC(CO)CCCCCCCCCCCCCCCCCCCCCCCC)cc3)coc12

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: 5,7-dihydroxy-3-[4-[(2R)-1-hydroxyhexacosan-2-yl]oxyphenyl]-8-[(2R)-2-hydroxy-3-methylbut-3-enyl]-6-(3-methylbut-2-enyl)chromen-4-one is a natural product found in Erythrina variegata with data available.
Molecule SMILES: COc1cc2c(c(OC)c1OC)-c1c(cc3c(c1OC)OCO3)C(OC(C)=O)C(C)C(C)C2OC(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: (8-Acetyloxy-3,4,5,19-tetramethoxy-9,10-dimethyl-15,17-dioxatetracyclo[10.7.0.02,7.014,18]nonadeca-1(19),2,4,6,12,14(18)-hexaen-11-yl) acetate is a natural product found in Kadsura coccinea and Kadsura ananosma with data available.
Molecule SMILES: CC(=O)NC1C(O)OC(COC2OC(C)C(O)C(O)C2O)C(OC2OC(CO)C(OC3OC(COC4OC(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)C(OC4OC(CO)C(O)C(O)C4NC(C)=O)C(OC4OC(COC5OC(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)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 91857847 is a member of carbohydrates and carbohydrate derivatives.
Molecule SMILES: CC(=O)OC1CC23CC24CCC(OC2OCC(O)C(O)C2O)C(C)(C)C4CCC3C2(C)CC3OC4(CC(C)C3C12C)OCC1(C)OC14

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: [1,4',6',12',17',17'-Hexamethyl-18'-(3,4,5-trihydroxyoxan-2-yl)oxyspiro[3,6-dioxabicyclo[3.1.0]hexane-4,8'-9-oxahexacyclo[11.9.0.01,21.04,12.05,10.016,21]docosane]-3'-yl] acetate is a natural product found in Actaea cimicifuga and Actaea racemosa with data available.
Molecule SMILES: COc1ccc(C2Oc3c(OC)cc4ccc(=O)oc4c3OC2CO)cc1OC

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: (2R,3R)-3-(3,4-dimethoxyphenyl)-2-(hydroxymethyl)-5-methoxy-2,3-dihydropyrano[3,2-h][1,4]benzodioxin-9-one is a natural product found in Hyoscyamus niger with data available.
Molecule SMILES: OC(C=C(Br)Br)C(Br)Br

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)-1,1,4,4-tetrabromobut-3-en-2-ol is a natural product found in Asparagopsis taxiformis with data available.
Molecule SMILES: CNCc1ccc(-c2[nH]c3cc(F)cc4c3c2CCNC4=O)cc1.O=P(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: Tell me something about this molecule: <molecule_2d>

assistant: Rucaparib Phosphate is the phosphate salt form of rucaparib, an orally bioavailable tricyclic indole and inhibitor of poly(ADP-ribose) polymerases (PARPs) 1 (PARP1), 2 (PARP2) and 3 (PARP3), with potential chemo/radiosensitizing and antineoplastic activities. Upon administration, rucaparib selectively binds to PARP1, 2 and 3 and inhibits PARP-mediated DNA repair. This enhances the accumulation of DNA strand breaks, promotes genomic instability and induces cell cycle arrest and apoptosis. This may enhance the cytotoxicity of DNA-damaging agents and reverse tumor cell resistance to chemotherapy and radiation therapy. PARPs are enzymes activated by single-strand DNA breaks that catalyze the post-translational ADP-ribosylation of nuclear proteins, which induces signaling and the recruitment of other proteins to repair damaged DNA. The PARP-mediated repair pathway plays a key role in DNA repair and is dysregulated in a variety of cancer cell types.
Molecule SMILES: Oc1ccc(C2CCc3ccc(O)cc3O2)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: Tupichinol C is a natural product found in Soymida febrifuga and Broussonetia kazinoki with data available.
Molecule SMILES: CCC[N+](CC)(CC)CCOC(=O)C(c1ccccc1)c1ccccc1.[Br-]

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: Penotonium bromide is a carboxylic ester having diphenylacetic acid as the carboxylic acid component and a 2-(trialkylammonium)ethanol as the alcohol component. It is a quaternary ammonium salt and a carboxylic ester. It contains a penotonium cation.
Molecule SMILES: COc1ccc2c(Cl)c1OC1C#CC=C(C#CC3=CCC(O)C31OC1OCC(NC(=O)c3c(C)ccc(C)c3O)C(C)(O)C1O)C1CN1C(=O)CC2O

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: MaduropeptinChromophore is a natural product found in Actinomadura madurae with data available.
Molecule SMILES: COc1ccc2c(c1)OCC(=Cc1ccc(OC)c(OC)c1)C2=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: 3-[(3,4-dimethoxyphenyl)methylidene]-7-methoxy-3,4-dihydro-2H-1-benzopyran-4-one is a natural product found in Caesalpinia pulcherrima with data available.
Molecule SMILES: CC(=O)c1c(O)c(C(C)=O)c(O)c(C2CCCN2)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: 6-(pyrrolidin-2-yl)DAPG is a natural product found in Pseudomonas protegens with data available.
Molecule SMILES: CC(=O)NC1C(O)CC(OCC2OC(OC3C(O)C(CO)OC(OC4C(CO)OC(O)C(O)C4O)C3O)C(NC(C)=O)C(OC3OC(CO)C(O)C(OC4(C(=O)O)CC(O)C(NC(=O)CO)C(C(O)C(O)CO)O4)C3O)C2O)(C(=O)O)OC1C(O)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: (2R,4S,5R,6R)-5-Acetamido-2-[[(2R,3S,4R,5R,6S)-5-acetamido-4-[(2R,3R,4S,5S,6R)-4-[(2S,4S,5R,6R)-2-carboxy-4-hydroxy-5-[(2-hydroxyacetyl)amino]-6-[(1R,2R)-1,2,3-trihydroxypropyl]oxan-2-yl]oxy-3,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-6-[(2R,3S,4S,5R,6S)-3,5-dihydroxy-2-(hydroxymethyl)-6-[(2R,3S,4R,5R,6R)-4,5,6-trihydroxy-2-(hydroxymethyl)oxan-3-yl]oxyoxan-4-yl]oxy-3-hydroxyoxan-2-yl]methoxy]-4-hydroxy-6-[(1R,2R)-1,2,3-trihydroxypropyl]oxane-2-carboxylic acid is a member of neuraminic acids.
Molecule SMILES: CC(=O)c1ccc2c(c1)C=CC(=CCl)CO2

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-(Chloromethylene)-2,3-dihydro-1-benzoxepin-7-yl]ethanone is a natural product found in Pterula with data available.
Molecule SMILES: C=C(C=Cc1c(OC)ccc2ccc(=O)oc12)CO

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: 8-[3-(Hydroxymethyl)buta-1,3-dienyl]-7-methoxychromen-2-one is a natural product found in Micromelum minutum with data available.
Molecule SMILES: CCC(=O)N1CC(C)C(OC)CN(C)C(=O)c2ccc(NC(=O)c3ccccc3)cc2OCC1C

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-[(5R,6R,9R)-5-methoxy-3,6,9-trimethyl-2-oxo-8-(1-oxopropyl)-11-oxa-3,8-diazabicyclo[10.4.0]hexadeca-1(12),13,15-trien-14-yl]benzamide is an azamacrocycle and a lactam.
Molecule SMILES: CC=C(CCC(C)C1CCC2C3=CCC4C(C)C(O)CCC4(C)C3CCC21C)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: Given the molecule <molecule_2d>, what can you tell me about it?

assistant: (Z)-24-ethylidenelophenol is a 3beta-hydroxy steroid and a Delta(7)-sterol. It derives from a hydride of a stigmastane.
Molecule SMILES: CC=C(CCC(C)C1CCC2C3=CCC4C(C)C(O)CCC4(C)C3CCC21C)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: alpha1-Sitosterol is a natural product found in Yucca gloriosa, Goniophlebium formosanum, and other organisms with data available.
Molecule SMILES: CC(C)=CCCC(C)=CCCC(C)=CCc1cc(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: Piperoic acid is a sesquiterpenoid.
Molecule SMILES: CC(C)=CCCC(C)=CCCC(C)=CCc1cc(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: Piperoic acid is a natural product found in Piper auritum with data available.
Molecule SMILES: COc1cc2c(cc1OC)CC(=O)N(CCCN(C)CC1Cc3cc(OC)c(OC)cc31)CC2.Cl

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: Ivabradine hydrochloride is a hydrochloride obtained by combining ivabradine with one molar equivalent of hydrochloric acid. Used to treat patients with angina who have intolerance to beta blockers and/or heart failure. It has a role as a cardiotonic drug. It contains an ivabradine(1+).
Molecule SMILES: COc1cc2c(cc1OC)CC(=O)N(CCCN(C)CC1Cc3cc(OC)c(OC)cc31)CC2.Cl

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: Ivabradine Hydrochloride is the hydrochloride salt form of ivabradine, an orally bioavailable, hyperpolarization-activated, cyclic nucleotide-gated (HCN) channel blocker, with negative chronotropic activity. Upon administration, ivabradine selectively binds to the intracellular portion of the HCN channel pore and blocks HCN channels in the pacemaker cells within the sinoatrial (SA) node. This inhibits the If (funny) pacemaker ion current, prevents the inward flow and intracellular accumulation of positively charged ions, reduces pacemaker activity and slows diastolic depolarization. This decreases heart rate, reduces myocardial oxygen demand and allows more time for blood to flow to the myocardium without affecting cardiac contractility. HCN channels, mixed sodium (Na+) and potassium (K+) channels that carry the inward If current, play a key role in the regulation of pacemaker firing rate in the SA node. The If pacemaker current, the inward flow of positively charged Na+-K+ ions, initiates the spontaneous diastolic depolarization phase and modulating heart rate.
Molecule SMILES: O=C(O)CC(O)CCCCCCCCO

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: (3R)-3,11-dihydroxyundecanoic acid is a dihydroxy monocarboxylic acid that is 11-hydroxyundecanoic acid in which the pro-R hydrogen beta to the carboxy group is replaced by a hydroxy group. It is a dihydroxy monocarboxylic acid, a (3R)-3-hydroxy fatty acid and an omega-hydroxy-medium-chain fatty acid. It is functionally related to an 11-hydroxyundecanoic acid.
Molecule SMILES: COC(=O)c1ccc(O)c(CC(O)C(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: Could you provide a description of this molecule <molecule_2d> ?

assistant: Hostmaniane is a 4-hydroxybenzoate ester.
Molecule SMILES: CCN1CCN(C(=O)NC(C(=O)NC2C(=O)N3C(C(=O)O)=C(CSc4nnnn4C)CSC23)c2ccc(O)cc2)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: Tell me something about this molecule: <molecule_2d>

assistant: (6R,7S)-7-[[(2R)-2-[[(4-ethyl-2,3-dioxo-1-piperazinyl)-oxomethyl]amino]-2-(4-hydroxyphenyl)-1-oxoethyl]amino]-3-[[(1-methyl-5-tetrazolyl)thio]methyl]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid is a peptide.
Molecule SMILES: Oc1ccc(C2Oc3cc(O)c4c5c3C2c2cc(O)cc(O)c2C(c2ccc(O)cc2)C5C(c2ccc(O)cc2)C4c2cc(O)cc(O)c2)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: Suffruticosol A is a natural product found in Paeonia suffruticosa with data available.
Molecule SMILES: COc1cc(C2CC(=O)c3c(cc(O)c(CC=C(C)CCC=C(C)C)c3O)O2)cc(OC)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: (2S)-3',5'-Dimethoxy-4',5,7-trihydroxy-6-[(2E)-3,7-dimethyl-2,6-octadienyl]-2,3-dihydroflavone is a natural product found in Paulownia tomentosa with data available.
Molecule SMILES: CC(C)=CCCC(C)C1CCC(CO)c2c1cc(C)c(O)c2O

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: (5S,8R)-8-(hydroxymethyl)-3-methyl-5-[(2S)-6-methylhept-5-en-2-yl]-5,6,7,8-tetrahydronaphthalene-1,2-diol is a natural product found in Eremophila duttonii with data available.