IDEA-AI4S/PubChemSFT huggingface dataset:
Molecule SMILES: CCCCCCn1c(C)nc2c(c1=O)c1nc3ccccc3nc1n2N=Cc1ccco1

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: LSM-25764 is a quinoxaline derivative.
Molecule SMILES: COc1cc(C=CC(=O)OCC2OC(Oc3cc(OC)c(OC)c(OC)c3)C(O)C(O)C2OC(=O)C=Cc2ccc(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: I'd like a short overview about this molecule <molecule_2d>. Can you do that?

assistant: [(2R,3S,4R,5R,6S)-4,5-dihydroxy-3-[(E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoyl]oxy-6-(3,4,5-trimethoxyphenoxy)oxan-2-yl]methyl (E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoate is a natural product found in Brucea javanica with data available.
Molecule SMILES: COc1c(C)ccc2c(O)c3c(cc12)C(=O)c1c(O)cc(C)cc1C3=O

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

user: <molecule_2d> The above is a compound. Could you please tell me something about it?

assistant: 4,11-Dihydroxy-2,8-dimethyl-7-methoxynaphthacene-5,12-dione is a natural product found in Nocardia brasiliensis with data available.
Molecule SMILES: CC(O)CCC(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: Describe this molecule: <molecule_2d> .

assistant: (2S,5S)-2-amino-5-hydroxyhexanoic acid is a natural product found in Crotalaria juncea with data available.
Molecule SMILES: O=C1OC(Cc2ccccc2)C(c2ccccc2)=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: S-xenofuranone B is a natural product found in Phyllosticta and Xenorhabdus szentirmaii with data available.
Molecule SMILES: C=C1CCC(O)C2(C)CC(O)C(C(C)C)CC12

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: (1R,4aS,6R,7S,8aR)-8a-methyl-4-methylidene-6-propan-2-yl-1,2,3,4a,5,6,7,8-octahydronaphthalene-1,7-diol is a natural product found in Panax japonicus with data available.
Molecule SMILES: O=Cc1ccc(-c2ccoc2)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-(Furan-3-yl)benzaldehyde is a natural product found in Sarcodontia crocea with data available.
Molecule SMILES: CCC=CCC=CCC=CCCCCCCCc1cccc(O)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: <molecule_2d> The above is a compound. Could you please tell me something about it?

assistant: Antibiotic SB 202742 is a hydroxybenzoic acid. It is functionally related to a salicylic acid.
Molecule SMILES: CC1=CCCC2(C)OC2C(=O)C2=CCC(C)C(C)(CC1)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: Provide a brief overview of this molecule <molecule_2d> .

assistant: (3S,5R,8E,12S,13R,16R)-16-hydroxy-5,9,12,13,16-pentamethyl-4-oxatricyclo[10.3.1.03,5]hexadeca-1(15),8-dien-2-one is a natural product found in Phoma with data available.
Molecule SMILES: CC=C(C)C(=O)OC1C(C)OC(OC2C(C)OC(OC3CCC4(C)C(=CCC5C4CCC4(C)C(C(C)OC6OC(COC7OC(CO)C(O)C(O)C7O)C(O)C(O)C6O)CCC54O)C3)CC2OC)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: Please give me some details about this molecule <molecule_2d> .

assistant: [5-Hydroxy-6-[6-[[14-hydroxy-10,13-dimethyl-17-[1-[3,4,5-trihydroxy-6-[[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]oxan-2-yl]oxyethyl]-1,2,3,4,7,8,9,11,12,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-yl]oxy]-4-methoxy-2-methyloxan-3-yl]oxy-4-methoxy-2-methyloxan-3-yl] 2-methylbut-2-enoate is a natural product found in Hoodia gordonii with data available.
Molecule SMILES: CN(CCCC(OC1OC(C(=O)O)C(O)C(O)C1O)c1cccnc1)N=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: 4-(Methylnitrosamino)-1-(3-pyridyl)-1-butanol glucuronide is a glucosiduronic acid.
Molecule SMILES: CN(CCCC(OC1OC(C(=O)O)C(O)C(O)C1O)c1cccnc1)N=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: 4-(Methylnitrosamino)-1-(3-Pyridyl)-1-Butanol Glucuronide is a non-carcinogenic and detoxified glucuronidated form of 4-(methylnitrosamino)-1-(3-pyridyl)-1-butanol (nicotine-derived nitrosamine alcohol; NNAL), which is the primary metabolite of the potentially carcinogenic nitrosamine 4-methylnitrosamino-1,3-pyridyl-1-butanone (nicotine-derived nitrosamine ketone; NNK). NNAL-gluconuronide is detected in the urine of subjects exposed to tobacco products.
Molecule SMILES: C=CCC1CC2(OC)CC(C(C)(C)OC)OC2=CC1=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: 4,12-Di-O-methylillifunone C is a natural product found in Illicium anisatum with data available.
Molecule SMILES: CC(O)C1CC(O)C2C3=CCC4CC(OC(=O)CC5CC(O)CO5)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: <molecule_2d> The above is a compound. Could you please tell me something about it?

assistant: Poriaprogesterol A is a natural product found in Wolfiporia cocos with data available.
Molecule SMILES: COc1c(C)c(C(C)(O)C(OC)C(C)=CC(C)=CC2(C)OC(C)C3(C)OC23)oc(=O)c1C

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: Methyl isoverrucosidinol is a natural product found in Penicillium with data available.
Molecule SMILES: CC=C(C)C(=O)OC1c2cc(OC)c(OC)c(OC)c2-c2c(cc(O)c(OC)c2OC)CC(C)C1(C)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: [(8S,9R,10S)-9,14-dihydroxy-3,4,5,15,16-pentamethoxy-9,10-dimethyl-8-tricyclo[10.4.0.02,7]hexadeca-1(16),2,4,6,12,14-hexaenyl] (E)-2-methylbut-2-enoate is a natural product found in Schisandra arisanensis with data available.
Molecule SMILES: CC(=O)OC1CCC2(C)C(CCC34OC3C3=C(C)C(=O)OC35OC5C24)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: Tell me something about this molecule: <molecule_2d>

assistant: Gelomulide B is a natural product found in Suregada multiflora with data available.
Molecule SMILES: COc1cc(Nc2ncc(F)c(Nc3ccc4c(n3)N(COP(=O)([O-])[O-])C(=O)C(C)(C)O4)n2)cc(OC)c1OC.[Na+].[Na+]

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: Fostamatinib Disodium is an orally available disodium salt of the Syk kinase inhibitor fostamatinib with potential anti-inflammatory and immunomodulating activities. Fostamatinib inhibits Syk kinase-mediated IgG Fc gamma receptor signaling, resulting in inhibition of the activation of mast cells, macrophages, and B-cells and related inflammatory responses and tissue damage. Syk kinase, widely expressed in hematopoietic cells, is a nonreceptor tyrosine kinase that is involved in coupling activated immunoreceptors to signal downstream events that mediate diverse cellular responses, including proliferation, differentiation, and phagocytosis.
Molecule SMILES: CCC(=O)N1C(CO)C(c2ccccc2)C12CN(Cc1ccccc1Cl)C2

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-[(2R,3R)-6-[(2-chlorophenyl)methyl]-2-(hydroxymethyl)-3-phenyl-1,6-diazaspiro[3.3]heptan-1-yl]-1-propanone is a member of benzenes, a ring assembly and a member of azetidines.
Molecule SMILES: COc1cc(OC)c2c(c1O)OC(c1ccccc1)CC2=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: (2S)-8-hydroxy-5,7-dimethoxy-2-phenyl-2,3-dihydrochromen-4-one is a natural product found in Uvaria dulcis with data available.
Molecule SMILES: C=C(CCC(C)C1CCC2C3CC=C4CC(O)CCC4(C)C3CCC12C)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: I'd like a short overview about this molecule <molecule_2d>. Can you do that?

assistant: Ergosta-5,24(28)-dien-3beta-ol is a natural product found in Heliotropium angiospermum, Sinularia brassica, and Sinularia gibberosa with data available.
Molecule SMILES: COc1cc(-c2oc3cc(OC4OC(C)C(O)C(O)C4O)cc(O)c3c(=O)c2OC2OC(COC3OC(C)C(O)C(O)C3O)C(O)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: Please give me some details about this molecule <molecule_2d> .

assistant: 5-Hydroxy-2-(4-hydroxy-3-methoxyphenyl)-7-(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy-3-[3,4,5-trihydroxy-6-[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxymethyl]oxan-2-yl]oxychromen-4-one is a natural product found in Typha latifolia and Eustoma grandiflorum with data available.
Molecule SMILES: CC(=O)OC1CC2C(C)(C)C(OC(=O)c3ccccc3)CC(OC(C)=O)C2(C)C2CCC3(C)C(=CCC3C3COC(C)(C)C(O)C(O)C3)C12C

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: [(1S,3R,5S,8R,9R,10S,13S,17S)-1,7-diacetyloxy-17-[(3S)-5,6-dihydroxy-7,7-dimethyloxepan-3-yl]-4,4,8,10,13-pentamethyl-2,3,5,6,7,9,11,12,16,17-decahydro-1H-cyclopenta[a]phenanthren-3-yl] benzoate is a natural product found in Melia volkensii with data available.
Molecule SMILES: C=CC1(C)CC(=O)C2C(C1)C(=O)CC1C(C)(C)CCCC21C

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,4aS,4bS,8aS,10aS)-2-ethenyl-2,4b,8,8-tetramethyl-3,4a,5,6,7,8a,9,10a-octahydro-1H-phenanthrene-4,10-dione is a natural product found in Vellozia compacta with data available.
Molecule SMILES: CC(CCCC=CC=CCCCC(=O)C=CC=CCCCCCN(O)C(=N)N)C(O)CC(O)CC(O)C(O)C(=O)NCC(=O)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 description of this molecule <molecule_2d> .

assistant: Octacosamicin B is a natural product found in Amycolatopsis and Amycolatopsis azurea with data available.
Molecule SMILES: CC(=O)OCC12CCC(C)C(C)(CCC3=CC(=O)OC3)C1CC(O)C=C2CO

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: Blinin is a natural product found in Eschenbachia blinii with data available.
Molecule SMILES: [Bi+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: Bismuth(3+) is a bismuth cation having a net electric charge of +3.
Molecule SMILES: [Bi+3]

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: Bismuth cation is a Bismuth.
Molecule SMILES: CC(C)(O)C1Cc2c(O)ccc(C(=O)C=Cc3ccc(O)cc3)c2O1

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)-1-[(2R)-4-hydroxy-2-(2-hydroxypropan-2-yl)-2,3-dihydro-1-benzofuran-7-yl]-3-(4-hydroxyphenyl)prop-2-en-1-one is a natural product found in Lespedeza cyrtobotrya with data available.
Molecule SMILES: C=C1C(OC(=O)C(C)=CC)CC(C(C)C)C2C(=CC)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: Please give me some details about this molecule <molecule_2d> .

assistant: (1Z,3aR,5R,7S,7aS)-1-Ethylideneoctahydro-4-methylene-7-(1-methylethyl)-2-oxo-1H-inden-5-yl (2Z)-2-methyl-2-butenoate is a natural product found in Tussilago farfara with data available.
Molecule SMILES: CCCC=CC=CC(=O)NCC(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: N-(2-Methylpropyl)octa-2,4-dienimidic acid is a natural product found in Piper nigrum, Zanthoxylum zanthoxyloides, and Piper sarmentosum with data available.
Molecule SMILES: O=C(O)CC(=Cc1ccccc1)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: Provide a brief overview of this molecule <molecule_2d> .

assistant: Butanedioic acid, (phenylmethylene)- is a natural product found in Artemisia argyi with data available.
Molecule SMILES: OCC1OC(OC2OC3CC4C(O)C(Cl)C(O)(CO3)C24)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: Provide a description of this molecule <molecule_2d> .

assistant: Glutinoside is a natural product found in Rehmannia glutinosa with data available.
Molecule SMILES: Nc1nc2ncc(CNc3ccc(C(=O)N(N=O)C(CCC(=O)O)C(=O)O)cc3)nc2c(=O)[nH]1

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

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

assistant: N-Nitrosofolic acid is a member of folic acids.
Molecule SMILES: C=CC(C=Cc1ccc(O)cc1)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> What do you know about the molecule?

assistant: Hinokiresinol is a natural product found in Drimiopsis maculata with data available.
Molecule SMILES: OCC1OC2OC3Cc4c(c5cc(O)c(O)cc5c5cc(O)c(O)cc45)OC3OC2C(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: Curcapitoside is a natural product found in Molineria capitulata with data available.
Molecule SMILES: C=C1CC23CCC4C(C)(O)CCCC4(C)C2CCC1C3

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: Ruilopeziol is a natural product found in Xylopia emarginata, Espeletia guacharaca, and Robinsonia thurifera with data available.
Molecule SMILES: CCCCCC=CCC=CCC=CCC=CCCCC(=O)NCCOP(=O)([O-])OCC(O)COC=CCCCCCCCCCCCCCCCC

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: 1-(1Z-octadecenyl)-sn-glycero-3-phospho-(N-arachidonoyl)ethanolamine(1-) is a 1-(alk-1Z-enyl)-sn-glycero-3-phospho-(N-acyl)ethanolamine(1-) obtained by deprotonation of the phosphate OH group of 1-(1Z-octadecenyl)-sn-glycero-3-phospho-(N-arachidonoyl)ethanolamine; major species at pH 7.3. It is a conjugate base of a 1-(1Z-octadecenyl)-sn-glycero-3-phospho-(N-arachidonoyl)ethanolamine.
Molecule SMILES: CCC=CCC=CCC=CCC=CCC=CCCCC(=O)OC(COC(=O)CCCCCCCCCCCCCCC)COP(=O)([O-])OCC[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: 1-hexadecanoyl-2-[(5Z,8Z,11Z,14Z,17Z)-icosapentaenoyl]-sn-glycero-3-phosphocholine is a phosphatidylcholine 36:5 in which the acyl groups specified at positions 1 and 2 are hexadecanoyl and (5Z,8Z,11Z,14Z,17Z)-eicosapentaenoyl respectively. It is functionally related to a hexadecanoic acid and an all-cis-5,8,11,14,17-icosapentaenoic acid.
Molecule SMILES: CCC=CCC=CCC=CCC=CCC=CCCCC(=O)OC(COC(=O)CCCCCCCCCCCCCCC)COP(=O)([O-])OCC[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: Tell me something about this molecule: <molecule_2d>

assistant: PC(16:0/20:5(5Z,8Z,11Z,14Z,17Z)) is a metabolite found in or produced by Saccharomyces cerevisiae.
Molecule SMILES: CC(=O)c1ccc2c(c1)CCC1C(C)(C(=O)O)CCCC21C

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: Angustanoic acid G is a natural product found in Illicium angustisepalum with data available.
Molecule SMILES: CCC(C)C1N=C(O)C(C)N=C(O)C(Cc2ccc(O)cc2)N=C(O)CN=C(O)C2CSSCC3N=C(O)CC(N=C(O)C(CC(=N)O)N=C(O)C(CSSCC(C(O)=NC(Cc4ccccc4)C(O)=NC(Cc4c[nH]c5ccccc45)C(=O)O)N=C(O)C(C(C)C)N=C1O)N=C(O)C(CO)N=C(O)CN=C(O)C(C(C)C)N=C(O)CN=C(O)C(CC(C)C)N=C3O)C(O)=NC(Cc1ccccc1)C(O)=NC(C)C(O)=NCC(O)=N2

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: D-N(1)Cys(2)-Leu-Gly-Val-Gly-Ser-D-Cys(3)-Asn-Asp(1)-Phe-D-Ala-Gly-D-Cys(2)-Gly-D-Tyr-Ala-D-aIle-Val-Cys(3)-Phe-Trp-OH is a natural product found in Streptomyces with data available.
Molecule SMILES: NCCCCCN(O)C(=O)CCC(=O)NCCCCCN(O)C(=O)CCC(=O)NCCCCCN(O)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: Given the molecule <molecule_2d>, what can you tell me about it?

assistant: Legonoxamine A is a natural product found in Streptomyces with data available.
Molecule SMILES: CSCCC(NC(=O)NC(Cc1cccc(O)c1)C(=O)O)C(=O)NC(C(=O)NC=C1CC(O)C(N2CCC(=O)NC2=O)O1)C(C)N(C)C(=O)C1Cc2cc(O)ccc2C(C)N1

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

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

assistant: 2-[[1-[[1-[[5-(2,4-Dioxo-1,3-diazinan-1-yl)-4-hydroxyoxolan-2-ylidene]methylamino]-3-[(6-hydroxy-1-methyl-1,2,3,4-tetrahydroisoquinoline-3-carbonyl)-methylamino]-1-oxobutan-2-yl]amino]-4-methylsulfanyl-1-oxobutan-2-yl]carbamoylamino]-3-(3-hydroxyphenyl)propanoic acid is a natural product found in Pseudomonas with data available.
Molecule SMILES: CC1(C)CCC2(C(=O)O)CCC3(C)C(=CCC4C5(C)CC(O)C(OC6OC(CO)C(OC7OC(CO)C(O)C(O)C7O)C(OC7OC(CO)C(O)C(O)C7O)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: <molecule_2d> What do you know about the molecule?

assistant: 2beta,23-Dihydroxy-3beta-[[3-O-beta-D-galactopyranosyl-4-O-beta-D-glucopyranosyl-beta-D-glucopyranosyl]oxy]olean-12-en-28-oic acid is a natural product found in Phytolacca dodecandra with data available.
Molecule SMILES: CC(CCc1ccccc1)NCC(O)c1ccc(O)c(C(N)=O)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: Labetalol is an antihypertensive agent with both alpha- and beta-adrenergic receptor blocking activity. Labetalol has been linked to several cases of clinically apparent drug induced liver disease, some of which have been severe and even fatal.
Molecule SMILES: CC(CCc1ccccc1)NCC(O)c1ccc(O)c(C(N)=O)c1

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: Labetalol is a diastereoisomeric mixture of approximately equal amounts of all four possible stereoisomers ((R,S)-labetolol, (S,R)-labetolol, (S,S)-labetalol and (R,R)-labetalol). It is an adrenergic antagonist used to treat high blood pressure. It has a role as an antihypertensive agent, a sympatholytic agent, an alpha-adrenergic antagonist and a beta-adrenergic antagonist. It contains a (R,R)-labetalol, a (S,S)-labetalol, a (R,S)-labetolol and a (S,R)-labetolol.
Molecule SMILES: CC(CCc1ccccc1)NCC(O)c1ccc(O)c(C(N)=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: Labetalol is a racemic mixture of 2 diastereoisomers where dilevalol, the R,R' stereoisomer, makes up 25% of the mixture. Labetalol is formulated as an injection or tablets to treat hypertension.  Labetalol was granted FDA approval on 1 August 1984.
Molecule SMILES: CC(CCc1ccccc1)NCC(O)c1ccc(O)c(C(N)=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: Labetalol is a beta-Adrenergic Blocker. The mechanism of action of labetalol is as an Adrenergic beta-Antagonist.
Molecule SMILES: CC(CCc1ccccc1)NCC(O)c1ccc(O)c(C(N)=O)c1

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: Labetalol is a third generation selective alpha-1-adrenergic antagonist and non-selective beta-adrenergic antagonist with vasodilatory and antihypertensive properties. Labetalol competitively binds to alpha-1-adrenergic receptors in vascular smooth muscle, thereby inhibiting the adrenergic stimulation of endothelial cell function and vasoconstriction in peripheral blood vessels. This agent also binds to beta-receptors in the bronchial and vascular smooth muscle, resulting in a decrease in adrenergic stimulation. The result is a decrease in resting and exercise heart rates, cardiac output, and in both systolic and diastolic blood pressure, thereby resulting in vasodilation, and negative chronotropic and inotropic cardiac effects.