IDEA-AI4S/PubChemSFT huggingface dataset:
Molecule SMILES: OCC1OC(Oc2cc(O)cc(C3c4c(O)cc5c6c4C(C(c4ccc(O)cc4)c4c(O)cc(O)cc4C6C(c4ccc(O)cc4)O5)C3c3ccc(O)cc3)c2)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> What do you know about the molecule?

assistant: (1S,2R,3R,9R,10S,17S)-2,9,17-tris(4-hydroxyphenyl)-3-[3-hydroxy-5-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]-8-oxapentacyclo[8.7.2.04,18.07,19.011,16]nonadeca-4(18),5,7(19),11(16),12,14-hexaene-5,13,15-triol is a natural product found in Cotylelobium lanceolatum with data available.
Molecule SMILES: Brc1cc(-c2c(Br)ccc(Br)c2Br)c(Br)c(Br)c1Br

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: 2,2',3,3',4,5,6'-Heptabromobiphenyl is a polybrominated biphenyl. Polybrominated biphenyls (PBBs) are a group of 209 synthetic organic compounds with 1-10 bromine atoms attached to biphenyl. They can be used as flame retardants and may be added to the plastics used to make products like computer monitors, televisions, textiles, and plastic foams to make them difficult to burn. However, the use of PBBs is banned or restricted in most areas due to their toxicity and persistence in the environment. (L628, L629)
Molecule SMILES: CCC(=O)N(c1ccccc1)C1CCN(CCc2ccccc2)CC1C

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: 3-methylfentanyl is the monocarboxylic acid amide resulting from the formal condensation of the aryl amino group of 3-methyl-N-phenyl-1-(2-phenylethyl)piperidin-4-amine with propanoic acid. It has a role as an opioid analgesic, a mu-opioid receptor agonist and a sedative. It is a member of piperidines and a monocarboxylic acid amide.
Molecule SMILES: CCC(=O)N(c1ccccc1)C1CCN(CCc2ccccc2)CC1C

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-Methylfentanyl is an opioid analgesic and is an analog of the potent opioid, fentanyl. 3-Methylfentanyl is one of the most powerful opioid drugs sold illegally and is estimated to be between 400-6000 times more potent than morphine in certain cases. 3-Methylfentanyl was initially discovered in 1974 and widespread illegal use of this drug has occurred since this time.
Molecule SMILES: CC(CCC(O)C(O)C(O)CO)C1CCC2(C)C1CCC1(C)C2C(C)CC2C3(C)CCCC(C)(C)C3CCC21C

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,3R,4R,7R)-7-[(3R,3aS,5aR,5bR,7aS,11aS,11bR,13S,13aR,13bS)-5a,5b,8,8,11a,13,13b-heptamethyl-1,2,3,3a,4,5,6,7,7a,9,10,11,11b,12,13,13a-hexadecahydrocyclopenta[a]chrysen-3-yl]octane-1,2,3,4-tetrol is a natural product found in Plakortis simplex with data available.
Molecule SMILES: CC1=CC=CC=CC(C)CNC(=O)CC(=O)CC2OC3C(O)CC(O)C4C=CC1C2C43

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: Verticilactam C is a natural product found in Streptomyces avermitilis with data available.
Molecule SMILES: C=C(C)C1CC2OC(O)(C(=C)CC(=O)C=C(C)CC3OC(=O)C24OC34)C1O

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: (1S,2S,4S,5S,6S,10Z,13S,14S)-5,6-dihydroxy-11-methyl-7-methylidene-4-prop-1-en-2-yl-15,17,18-trioxatetracyclo[11.2.2.12,6.01,14]octadec-10-ene-9,16-dione is a natural product found in Antillogorgia bipinnata with data available.
Molecule SMILES: COC(=O)CC1C(C)(C)C(OC(C)=O)C2(OC(C)=O)CC3=C4CC(=O)OC(c5ccoc5)C4(C)CCC3C1(C)C2=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: methyl 2-[(1R,2R,5R,6R,13R,14S,16R)-13,14-diacetyloxy-6-(furan-3-yl)-1,5,15,15-tetramethyl-8,17-dioxo-7-oxatetracyclo[11.3.1.02,11.05,10]heptadec-10-en-16-yl]acetate is a natural product found in Khaya ivorensis and Khaya senegalensis with data available.
Molecule SMILES: O=C1CC(c2ccc(O)cc2)Oc2cc(OS(=O)(=O)O)cc(O)c21

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: Naringenin 7-sulfate is a natural product found in Cunninghamella elegans with data available.
Molecule SMILES: COc1cc2ccc(=O)oc2c(O)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: Fraxidin is a natural product found in Artemisia minor, Melilotus messanensis, and other organisms with data available.
Molecule SMILES: CCSCC

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: Diethyl sulfide appears as a colorless oily liquid with a garlic-like odor. Less dense than water. Vapors heavier than air. May irritate skin and eyes. Used to make other chemicals.
Molecule SMILES: CCSCC

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: Diethyl sulfide is an ethyl sulfide compound having two ethyl groups attached to a sulfur atom.
Molecule SMILES: CCSCC

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: Diethylsulfide is a metabolite found in or produced by Saccharomyces cerevisiae.
Molecule SMILES: CCSCC

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: Diethyl sulfide is a natural product found in Zingiber officinale with data available.
Molecule SMILES: CC1(C)CCCC2(C)C1CCC1(C)C(CCc3ccoc3)C(=COS(=O)(=O)[O-])CCC12.CN(C)C(=N)N

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: Suvanine is an organic molecular entity. It has a role as a metabolite.
Molecule SMILES: Cc1noc(C)c1S(=O)(=O)N(C)CC1OCc2ccccc2-c2c(n(C)c3ccccc23)C(=O)N(C(C)CO)CC1C

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

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

assistant: LSM-11523 is an indolyl carboxylic acid.
Molecule SMILES: CC1=C(C)C(=O)OC(C(C)(O)C2CCC3(O)C4CC=C5CC=CC(=O)C5(C)C4CCC23C)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: (2R)-2-[(1R)-1-hydroxy-1-[(8R,9S,10R,13R,14S,17S)-14-hydroxy-10,13-dimethyl-1-oxo-7,8,9,11,12,15,16,17-octahydro-4H-cyclopenta[a]phenanthren-17-yl]ethyl]-4,5-dimethyl-2,3-dihydropyran-6-one is a natural product found in Withania coagulans with data available.
Molecule SMILES: COc1cc(C(O)CN)ccc1O

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-[(1S)-2-amino-1-hydroxyethyl]-2-methoxyphenol is a natural product found in Solanum tuberosum with data available.
Molecule SMILES: CC(=O)OC1OC=C(COC(=O)C(OC(=O)CC(C)C)C(C)C)C2(O)CC(OC(=O)CC(C)C)C(O)(COC(=O)C(OC(=O)CC(C)C)C(C)C)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: [(1S,4aR,6R,7S,7aS)-1-acetyloxy-4a,7-dihydroxy-6-(3-methylbutanoyloxy)-7-[[(2R)-3-methyl-2-(3-methylbutanoyloxy)butanoyl]oxymethyl]-1,5,6,7a-tetrahydrocyclopenta[c]pyran-4-yl]methyl (2R)-3-methyl-2-(3-methylbutanoyloxy)butanoate is a natural product found in Valeriana jatamansi with data available.
Molecule SMILES: COCC1Cc2cc(OC)c(OC)cc2C(c2ccc(OC)c(OC)c2)C1COC

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: Phyltetralin is a natural product found in Phyllanthus virgatus and Phyllanthus urinaria with data available.
Molecule SMILES: CC(=O)OC1CCC2(C)C(CCC3(C)C2CC(=O)C2(O)C4CC(C)(C)CCC4(C)CCC32C)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: <molecule_2d> The above is a compound. Could you please tell me something about it?

assistant: Rubiprasin B is a natural product found in Rubia argyi, Rubia cordifolia, and Rubia akane with data available.
Molecule SMILES: C[NH2+]C(CCSC)C(=O)[O-]

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

user: Could you give me a brief overview of this molecule <molecule_2d> ?

assistant: N-methyl-L-methionine zwitterion is zwitterionic form of N-methyl-L-methionine arising from transfer of a proton from the carboxy to the amino group; major species at pH 7.3. It is a tautomer of a N-methyl-L-methionine.
Molecule SMILES: CC(=O)NC1C(OC2C(O)C(CO)OC(OC3C(O)C(COC4(C(=O)O)CC(O)C(NC(C)=O)C(C(O)C(O)CO)O4)OC(O)C3NC(C)=O)C2OC2OC(C)C(O)C(O)C2O)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: Given the molecule <molecule_2d>, what can you tell me about it?

assistant: (2R,4S,5R,6R)-5-Acetamido-2-[[(2R,3R,4R,5R)-5-acetamido-4-[(2R,3R,4S,5S,6R)-4-[(2S,3R,4R,5S,6R)-3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-5-hydroxy-6-(hydroxymethyl)-3-[(2S,3S,4R,5S,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]oxy-3,6-dihydroxyoxan-2-yl]methoxy]-4-hydroxy-6-[(1R,2R)-1,2,3-trihydroxypropyl]oxane-2-carboxylic acid is a member of neuraminic acids.
Molecule SMILES: CC1CN(C(C)CO)S(=O)(=O)c2ccc(C#CCN(C)C)cc2OC1CN(C)Cc1ccccc1

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: (2S)-2-[(4R,5S)-8-[3-(dimethylamino)prop-1-ynyl]-4-methyl-5-[[methyl-(phenylmethyl)amino]methyl]-1,1-dioxo-4,5-dihydro-3H-6,1$l^{6},2-benzoxathiazocin-2-yl]-1-propanol is an aromatic amine.
Molecule SMILES: COc1cc(OC)c(-c2cc3c(OC)c(O)ccc3o2)cc1O

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: Gnetumelin B is a natural product found in Gnetum montanum with data available.
Molecule SMILES: CC(C)=CC1CC(C)C2(CCC3(C)CC4C(C)=CC(=O)C4=C(CO)CCC32)O1

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

user: Could you give me a brief overview of this molecule <molecule_2d> ?

assistant: 8-deoxyophiobolin J is a natural product found in Bipolaris oryzae with data available.
Molecule SMILES: O=C(O)C1OC(Oc2cc(O)c3c(=O)cc(-c4ccc(O)cc4)oc3c2)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 provide a description of this molecule <molecule_2d> ?

assistant: Apigenin 7-glucuronide is a member of flavonoids and a glucosiduronic acid.
Molecule SMILES: O=C(O)C1OC(Oc2cc(O)c3c(=O)cc(-c4ccc(O)cc4)oc3c2)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: Apigenin 7-glucuronide is a natural product found in Galeopsis tetrahit, Galeopsis ladanum, and other organisms with data available.
Molecule SMILES: CSc1nc2ccc(NC(=O)C3CC(=O)N(Cc4ccco4)C3)cc2s1

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-furanylmethyl)-N-[2-(methylthio)-1,3-benzothiazol-6-yl]-5-oxo-3-pyrrolidinecarboxamide is a member of benzothiazoles.
Molecule SMILES: CCCCCCC=CC#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: Please give me some details about this molecule <molecule_2d> .

assistant: Pyrulic acid is a long-chain fatty acid.
Molecule SMILES: CCCCCCC=CC#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: <molecule_2d> What do you know about the molecule?

assistant: Pyrulic acid is a natural product found in Jodina rhombifolia with data available.
Molecule SMILES: CC1CCCC(O)C(O)CCC=Cc2cc(O)cc(O)c2C(=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 brief overview of this molecule <molecule_2d> .

assistant: 5'-Hydroxyzearalenol is a natural product found in Fusarium with data available.
Molecule SMILES: CCCC(=O)OCC(COP(=O)([O-])OC1C(O)C(O)C(O)C(OP(=O)([O-])[O-])C1O)OC(=O)CCC

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: 1,2-dibutyryl-sn-glycero-3-phospho-(1'D-myo-inositol-5'-phosphate)(3-) is a 1-phosphatidyl-1D-myo-inositol 5-phosphate(3-) arising from deprotonation of the phosphate OH groups of 1,2-dibutyryl-sn-glycero-3-phospho-(1'D-myo-inositol-5'-phosphate); major species at pH 7.3. It is a conjugate base of a 1,2-dibutyryl-sn-glycero-3-phospho-(1'D-myo-inositol-5'-phosphate).
Molecule SMILES: CC1OC(OC2C(CO)OC(OCC3OC(OC(=O)C45CC=C6C7CCC8C(C)(C)C(=O)CCC8(C)C7CCC6C4(C)CC(C)(C(=O)O)CC5)C(O)C(O)C3O)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: Provide a brief overview of this molecule <molecule_2d> .

assistant: (2R,4aS,6aS,6bR,8aR,12aR,14aS,14bS)-4a-[(2S,3R,4S,5S,6R)-6-[[(2R,3R,4R,5S,6R)-3,4-dihydroxy-6-(hydroxymethyl)-5-[(2R,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]oxymethyl]-3,4,5-trihydroxyoxan-2-yl]oxycarbonyl-2,9,9,12a,14b-pentamethyl-10-oxo-1,3,4,5,6a,6b,7,8,8a,11,12,13,14,14a-tetradecahydropicene-2-carboxylic acid is a natural product found in Heptapleurum bodinieri with data available.
Molecule SMILES: NC(N)=[NH+]CCCC(C(=O)[O-])N1CCC1=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: Deoxyamidinoproclavaminic acid zwitterion is zwitterionic form of deoxyamidinoproclavaminic acid. It is a tautomer of a deoxyamidinoproclavaminic acid.
Molecule SMILES: COc1c(C(C)OS(=O)(=O)O)ccc2occc12

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-methoxy-1-benzofuran-5-yl)ethoxy]sulfonic acid is a member of benzofurans.
Molecule SMILES: CCCCCCCCC1CCCc2c1c(=O)c(OC)c(CO)n2OC

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: (5R)-2-(hydroxymethyl)-1,3-dimethoxy-5-octyl-5,6,7,8-tetrahydroquinolin-4-one is a natural product found in Waltheria indica with data available.
Molecule SMILES: COc1ccc2c(c1O)C(NC(C)=O)CCc1cc(OC)c(OC)c(OC)c1-2

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: (-)-Androbiphenyline is a natural product found in Colchicum ritchii and Androcymbium palaestinum with data available.
Molecule SMILES: CC(C)n1nccc1-c1ncccc1COc1cccc(O)c1C=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: Voxelotor is a novel hemoglobin S polymerization inhibitor for the treatment of sickle cell disease. This is a genetically inherited condition most prevalent in the Middle East, Africa, and certain parts of India. Sickle cell disease can lead to excruciating pain, stroke, infection, and various other complications arising from the blockage of blood vessels.  Voxelotor was granted accelerated FDA approval on November 25 2019, as it is likely to be a promising treatment for the 100,000 individuals in the U.S. suffering from the disease, in addition to 20 million others worldwide. It was developed by Global Blood Therapeutics, Inc. and is unique from other drugs used to treat sickle cell anemia, such as [hydroxyurea], [L-glutamine], and [crizanlizumab] due to its novel mechanism of action. The EMA approved the use of voxelotor for the treatment of hemolytic anemia associated with sickle cell disease in February 2022.
Molecule SMILES: CC(C)n1nccc1-c1ncccc1COc1cccc(O)c1C=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: Voxelotor is an oral inhibitor of hemoglobin S polymerase that is used in the therapy of sickle cell disease. Voxelotor has been associated with rare instances of mild-to-moderate serum enzyme elevations during therapy, but has not been linked to instances of idiosyncratic acute liver injury.
Molecule SMILES: CC(C)n1nccc1-c1ncccc1COc1cccc(O)c1C=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: Voxelotor is an orally bioavailable modulator and stabilizer of sickle cell hemoglobin (HbS), with potential use in the treatment of sickle cell disease (SCD).  Upon administration, voxelotor targets and covalently binds to the N-terminal valine of the alpha chain of HbS. This stabilizes HbS, thereby improving oxygen binding affinity. The binding of voxelotor to HbS prevents HbS polymerization, reduces sickling, decreases red blood cell (RBC) damage and increases the half-life of RBCs. This improves blood flow and decreases hemolytic anemia.
Molecule SMILES: COc1cc2c(cc1OC)-c1c3c(c(OC)c4c1C(C2)N(C)CC4)OCO3

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: Ocotein is a natural product found in Thalictrum delavayi, Cassytha, and other organisms with data available.
Molecule SMILES: COC(=O)C1OC(OC2CCC3(C)C(CCC4(C)C3CC=C3C5CC(C)(C)CC(O)C5(C)CCC34C)C2(C)CO)C(OC2OC(CO)C(O)C(O)C2OC2OC(C)C(O)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: Soyasaponin I methyl ester is a natural product found in Impatiens siculifer and Pisum sativum with data available.
Molecule SMILES: C=C(C)C(O)Cc1cc(C=CC(=O)c2cc(CC=C(C)C)c(O)cc2O)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: (E)-1-[2,4-dihydroxy-5-(3-methylbut-2-enyl)phenyl]-3-[4-hydroxy-3-[(2R)-2-hydroxy-3-methylbut-3-enyl]phenyl]prop-2-en-1-one is a natural product found in Dorstenia barteri with data available.
Molecule SMILES: COc1ccc(C2CC(=O)c3c(O)c(C)c(O)c(C)c3O2)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: Describe this molecule: <molecule_2d> .

assistant: 2'-Hydroxymatteucinol is a natural product found in Pentarhizidium orientale with data available.
Molecule SMILES: CCCCCCCCCCCCCCCCC(C)CC(C)CC(C)C=C(C)C(=O)OC1C(O)C(CO)OC(OC2OC(CO)C(O)C(O)C2OS(=O)(=O)O)C1OC(=O)CCCCCCCCCCCCCCC

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: 2-O-palmitoyl-2'-O-sulfo-3-O-[(2E,4S,6S,8S)-2,4,6,8-tetramethyltetracos-2-enoyl]-alpha,alpha-trehalose is a sulfoglycolipid in which alpha,alpha-trehalose, sulfated at the 2'-position, is acylated at the 2-position with palmitic acid, and at the 3-position with (2E,4S,6S,8S)-2,4,6,8-tetramethyltetracos-2-enoic acid. It is a sulfoglycolipid and a polyacyl alpha,alpha-trehalose derivative. It is functionally related to an alpha,alpha-trehalose.
Molecule SMILES: CC1CCC2(O)C(C)(C)C3CCC2(C)C1(O)C3

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: (1R,3R,6S,7R,8S)-2,2,6,8-tetramethyltricyclo[5.3.1.03,8]undecane-3,7-diol is a natural product found in Pogostemon cablin with data available.
Molecule SMILES: CC1OC(OC2C(O)C(OCCc3ccc(O)c(O)c3)OC(COC3OC(CO)C(O)C(O)C3O)C2OC(=O)C=Cc2ccc(O)c(O)c2)C(OC2OCC(O)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: Tell me something about this molecule: <molecule_2d>

assistant: [(2R,3R,4R,5R,6R)-4-[(2S,3R,4S,5S,6R)-4,5-dihydroxy-6-methyl-3-[(2R,3S,4R,5S)-3,4,5-trihydroxyoxan-2-yl]oxyoxan-2-yl]oxy-6-[2-(3,4-dihydroxyphenyl)ethoxy]-5-hydroxy-2-[[(2S,3S,4R,5R,6S)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]oxan-3-yl] (E)-3-(3,4-dihydroxyphenyl)prop-2-enoate is a natural product found in Marrubium velutinum with data available.
Molecule SMILES: CC1=C(CCOP(=O)(O)OP(=O)(O)O)SC(=C(O)CO)N1Cc1cnc(C)nc1N

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: Alpha,beta-Dihydroxyethyl-TPP is a thiamine phosphate.
Molecule SMILES: O=C(O)CNC(=O)c1cccc(C(F)(F)F)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> What do you know about the molecule?

assistant: M-Trifluoromethylhippuric acid is a N-acylglycine. It is functionally related to a N-benzoylglycine.
Molecule SMILES: COC(CN(C)C(=O)C1CC1)C(C)CN(C(=O)Nc1ccc(C(F)(F)F)cc1)C(C)CO

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: N-[(2S,3S)-4-[[(2R)-1-hydroxypropan-2-yl]-[oxo-[4-(trifluoromethyl)anilino]methyl]amino]-2-methoxy-3-methylbutyl]-N-methylcyclopropanecarboxamide is a member of ureas.