IDEA-AI4S/PubChemSFT huggingface dataset:
Molecule SMILES: COC1CC2(CCC3(O2)C(C)CC2OC(=O)C4(C)CCCC3(C)C24)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: <molecule_2d> The above is a compound. Could you please tell me something about it?

assistant: CID 162984525 is a natural product found in Marrubium anisodon with data available.
Molecule SMILES: CC1=C(CCC(C)COC2OC(CO)C(O)C(O)C2O)OC2CC3C4CCC5CC(OC6OC(CO)C(O)C(O)C6OC6OC(C)C(O)C(O)C6O)C(O)CC5(C)C4CCC3(C)C12

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: Tuberoside A [saponin] is a natural product found in Allium tuberosum with data available.
Molecule SMILES: CCCCCCCCCCCC1NC(C(=O)O)CS1

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: 4-thiazolidinecarboxylic acid, 2-undecyl-, (4r)- is a L-alpha-amino acid.
Molecule SMILES: CC(C)=CCCC(C(=O)O)C1C(O)C(O)C2(C)C3=CCC4C(C)(CCC(O)C4(C)C)C3=CCC12C

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: Irpeksolactin E is a natural product found in Irpex lacteus with data available.
Molecule SMILES: Cc1csc(NC(=O)C2CCCN2C(=O)OCC(C)C)n1

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-[[(4-methyl-2-thiazolyl)amino]-oxomethyl]-1-pyrrolidinecarboxylic acid 2-methylpropyl ester is a proline derivative.
Molecule SMILES: CC(C)=CCC12CC3CC4C(C)(C)CCC4(C1=O)C(=O)C(C(=O)c1ccccc1)(C2=O)C3(C)C

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,5S,7R,9R,11S)-9-benzoyl-4,4,8,8-tetramethyl-11-(3-methylbut-2-enyl)tetracyclo[7.3.1.17,11.01,5]tetradecane-10,12,13-trione is a natural product found in Hypericum henryi with data available.
Molecule SMILES: COC1CC23C(=CC1O)CCN2CCc1cc(O)c(O)cc13

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,3S,13bS)-2-methoxy-2,3,5,6,8,9-hexahydro-1H-indolo[7a,1-a]isoquinoline-3,11,12-triol is a natural product found in Erythrina variegata with data available.
Molecule SMILES: CC12C=CC(=O)C=C1CCC1C2C(O)CC2(C)C1CC(O)C2(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: I'd like a short overview about this molecule <molecule_2d>. Can you do that?

assistant: 16-alpha-hydroxyprednisolone is a 21-hydroxy steroid.
Molecule SMILES: CC1CCCCOC(CN(C)CC2CC2)C(C)CN(C(C)CO)C(=O)c2cc(NS(=O)(=O)c3ccc(F)cc3)ccc2O1

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: N-[(3R,9S,10S)-9-[[cyclopropylmethyl(methyl)amino]methyl]-12-[(2S)-1-hydroxypropan-2-yl]-3,10-dimethyl-13-oxo-2,8-dioxa-12-azabicyclo[12.4.0]octadeca-1(14),15,17-trien-16-yl]-4-fluorobenzenesulfonamide is an azamacrocycle and a lactam.
Molecule SMILES: C=CC1C(OC2OC(CO)C(O)C(O)C2O)OC=C(C(=O)OC2CC3C(C(=O)OC)=COC(OC4OC(CO)C(O)C(O)C4O)C3C2C)C1CC=C(C=O)C1C(C(=O)OC2CC3C(C(=O)OC)=COC(OC4OC(CO)C(O)C(O)C4O)C3C2C)=COC(OC2OC(CO)C(O)C(O)C2O)C1C=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: methyl (1S,4aS,6S,7R,7aS)-6-[(2S,3R,4S)-4-[(E)-3-[(2S,3R,4R)-5-[[(1S,4aS,6S,7R,7aS)-4-methoxycarbonyl-7-methyl-1-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-1,4a,5,6,7,7a-hexahydrocyclopenta[c]pyran-6-yl]oxycarbonyl]-3-ethenyl-2-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3,4-dihydro-2H-pyran-4-yl]-4-oxobut-2-enyl]-3-ethenyl-2-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3,4-dihydro-2H-pyran-5-carbonyl]oxy-7-methyl-1-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-1,4a,5,6,7,7a-hexahydrocyclopenta[c]pyran-4-carboxylate is a natural product found in Strychnos spinosa with data available.
Molecule SMILES: CC12CCC3c4ccc(O)cc4C(OCC(=O)NCC(=O)O)CC3C1CCC2O

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: 6beta-[N-(carboxymethylamino)carbonyl]methoxy-17beta-estradiol is a steroid acid that consists of 17beta-estradiol bearing an N-(carboxymethylamino)carbonylmethoxy at the 6beta-position It is a steroid acid and a monocarboxylic acid. It is functionally related to a 17beta-estradiol.
Molecule SMILES: COc1cc(C=CC(=O)OCC2OC(OC3(COC(=O)C=Cc4ccc(O)cc4)OC(COC(=O)C=Cc4ccc(O)cc4)C(O)C3OC(=O)C=Cc3ccc(O)cc3)C(OC(C)=O)C(O)C2OC(C)=O)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: Bvuhzouvuwdzgr-vahuyremsa- is a natural product found in Persicaria pensylvanica and Persicaria bungeana with data available.
Molecule SMILES: CC1(C(=O)O)CCC2(C)CCC3(C)C(=CC(=O)C4C5(C)CCC(OC(=O)CCC(=O)O)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: Provide a description of this molecule <molecule_2d> .

assistant: (2S,4aS,6aS,6bR,10S,12aS,14bR)-10-(3-carboxy-1-oxopropoxy)-2,4a,6a,6b,9,9,12a-heptamethyl-13-oxo-3,4,5,6,6a,7,8,8a,10,11,12,14b-dodecahydro-1H-picene-2-carboxylic acid is a triterpenoid and a hemisuccinate.
Molecule SMILES: C=C1OC=C(C(=O)OC)C2CC3c4[nH]c5cc(OC)c(OC)cc5c4CCN3CC12

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: Darcyribeirine is a natural product found in Rauvolfia grandiflora with data available.
Molecule SMILES: C=C(N=C(O)C(N=C(O)C(Cc1cnc[nH]1)N=C(O)C1CSC(C)C2N=C(O)C(C(C)CC)N=C(O)C(N=C(O)C(CCC(=N)O)N=C(O)C(CC(C)C)N=C(O)C(Cc3ccccc3)N=C(O)C3CSC(C)C(N=C(O)C(N=C(O)C4CSC(C)C(N=C(O)C5CSCC(N=C(O)C(CCCCN)N=C(O)C(N)Cc6c[nH]c7ccccc67)C(O)=NC(CCC(=O)O)C(O)=NC(=C)C(O)=NC(C(C)C)C(O)=N5)C(=O)N5CCCC5C(O)=NCC(O)=N4)C(C)C)C(O)=NCC(O)=NC(C(C)C)C(O)=NC(CC(C)C)C(O)=NC(CCC(=N)O)C(O)=NC(=CC)C(O)=N3)C(C)SCC(N=C2O)C(O)=NC(CC(=N)O)C(O)=N1)C(C)CC)C(O)=NC(CCCCN)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: NA is a natural product found in Bacillus subtilis with data available.
Molecule SMILES: COc1cc2c(cc1OC)-c1cc3nc4ccccc4nc3n1C(C)(C)C2

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: LSM-2128 is a quinoxaline derivative.
Molecule SMILES: CC1OC(Oc2cc(O)c3c(=O)c(OC4OC(CO)C(O)C4OC4OCC(O)(CO)C4O)c(-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: Provide a brief overview of this molecule <molecule_2d> .

assistant: alpha-Rhamnoisorobin 3-O-(2-O-beta-D-apiofuranosyl-alpha-L-arabinofuranoside) is a natural product found in Cinnamomum burmanni, Cinnamomum sieboldii, and Cinnamomum osmophloeum with data available.
Molecule SMILES: COc1cccc(-c2ccc(C3C(CO)N4CCCCN(C(=O)c5ccc(F)cc5)CC34)cc2)c1

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: (4-fluorophenyl)-[(8R,9S,10R)-10-(hydroxymethyl)-9-[4-(3-methoxyphenyl)phenyl]-1,6-diazabicyclo[6.2.0]decan-6-yl]methanone is a member of biphenyls.
Molecule SMILES: N#CCc1cccs1

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-thienylacetonitrile is a nitrile that is acetonitrile where one of the methyl hydrogens is substituted by a 2-thienyl group. It is a nitrile and a member of thiophenes. It is functionally related to an acetonitrile.
Molecule SMILES: Clc1cc(Cl)cc(-c2c(Cl)cc(Cl)c(Cl)c2Cl)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: 2,3,3',4,5',6-Hexachlorobiphenyl is one of 209 polychlorinated biphenyls (PCBs). PCBs are a group of synthetic organic compounds with 1-10 chlorine atoms attached to biphenyl. They were manufactured as commercial mixtures but banned in the 1970's because they were found to bioaccumulate and cause harmful health effects. However, PCBs do not break down readily and are still found in the environment. (L4)
Molecule SMILES: COC(=O)CC1(C)C(C(C)(C)C(=O)OC)CCC2(C)C3=CCC4(C(=O)O)CCC(C)(C)CC4C3(C)CCC21

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: (1R,4aR,6aS,10bS)-2-(1-methoxy-2-methyl-1-oxopropan-2-yl)-1-(2-methoxy-2-oxoethyl)-1,4a,9,9,10b-pentamethyl-3,4,6,7,8,10,10a,11,12,12a-decahydro-2H-chrysene-6a-carboxylic acid is a natural product found in Elateriospermum tapos with data available.
Molecule SMILES: CCC(Nc1ncnc(C)c1Cl)c1ccc(OC(F)F)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: (R)-diflumetorim is a 5-chloro-N-{1-[4-(difluoromethoxy)phenyl]propyl}-6-methylpyrimidin-4-amine that is the (R)-enantiomer of diflumetorim. It is an enantiomer of a (S)-diflumetorim.
Molecule SMILES: CC=CCCC1OC(=O)c2c(O)c(CC=C(C)C)cc(O)c2C1OC

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: (-)-Eurotiumide D is a natural product found in Eurotium with data available.
Molecule SMILES: COc1ccc(CC2c3c(cc4c(c3O)OCO4)CCN2C)c(CO)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: (5S)-5-[[2-(hydroxymethyl)-3,4-dimethoxyphenyl]methyl]-6-methyl-7,8-dihydro-5H-[1,3]dioxolo[4,5-g]isoquinolin-4-ol is a natural product found in Papaver pseudo-orientale and Papaver orientale with data available.
Molecule SMILES: Cc1ccc(C(=O)CC2=NCC(C)NC2=O)cc1

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-methyl-5-[2-(4-methylphenyl)-2-oxoethyl]-2,3-dihydro-1H-pyrazin-6-one is an aromatic ketone.
Molecule SMILES: COc1ccc2nc(S(=O)Cc3ncc(C)c(OC)c3C)[nH]c2c1

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: Esomeprazole is a 5-methoxy-2-{[(4-methoxy-3,5-dimethylpyridin-2-yl)methyl]sulfinyl}-1H-benzimidazole that has S configuration at the sulfur atom. An inhibitor of gastric acid secretion, it is used (generally as its sodium or magnesium salt) for the treatment of gastro-oesophageal reflux disease, dyspepsia, peptic ulcer disease, and Zollinger-Ellison syndrome. It has a role as a histamine antagonist, an EC 3.6.3.10 (H(+)/K(+)-exchanging ATPase) inhibitor, an anti-ulcer drug and an EC 1.4.3.4 (monoamine oxidase) inhibitor. It is a conjugate acid of an esomeprazole(1-). It is an enantiomer of a (R)-omeprazole.
Molecule SMILES: COc1ccc2nc(S(=O)Cc3ncc(C)c(OC)c3C)[nH]c2c1

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: Esomeprazole, sold under the brand name Nexium, is a proton pump inhibitor (PPI) medication used for the management of gastroesophageal reflux disease (GERD), for gastric protection to prevent recurrence of stomach ulcers or gastric damage from chronic use of NSAIDs, and for the treatment of pathological hypersecretory conditions including Zollinger-Ellison (ZE) Syndrome. It can also be found in quadruple regimens for the treatment of H. pylori infections along with other antibiotics including [DB01060], [DB01211], and [DB00916], for example. Its efficacy is considered similar to other medications within the PPI class including [DB00338], [DB00213], [DB00448], [DB05351], and [DB01129]. Esomeprazole is the s-isomer of [DB00338], which is a racemate of the S- and R-enantiomer. Esomeprazole has been shown to inhibit acid secretion to a similar extent as [DB00338], without any significant differences between the two compounds in vitro.   Esomeprazole exerts its stomach acid-suppressing effects by preventing the final step in gastric acid production by covalently binding to sulfhydryl groups of cysteines found on the (H+, K+)-ATPase enzyme at the secretory surface of gastric parietal cells. This effect leads to inhibition of both basal and stimulated gastric acid secretion, irrespective of the stimulus. As the binding of esomeprazole to the (H+, K+)-ATPase enzyme is irreversible and new enzyme needs to be expressed in order to resume acid secretion, esomeprazole's duration of antisecretory effect persists longer than 24 hours.  PPIs such as esomeprazole have also been shown to inhibit the activity of dimethylarginine dimethylaminohydrolase (DDAH), an enzyme necessary for cardiovascular health. DDAH inhibition causes a consequent accumulation of the nitric oxide synthase inhibitor asymmetric dimethylarginie (ADMA), which is thought to cause the association of PPIs with increased risk of cardiovascular events in patients with unstable coronary syndromes.  Due to their good safety profile and as several PPIs are available over the counter without a prescription, their current use in North America is widespread. Long term use of PPIs such as esomeprazole has been associated with possible adverse effects, however, including increased susceptibility to bacterial infections (including gastrointestinal C. difficile), reduced absorption of micronutrients such as iron and B12, and an increased risk of developing hypomagnesemia and hypocalcemia which may contribute to osteoporosis and bone fractures later in life.  Rapid discontinuation of PPIs such as esomeprazole may cause a rebound effect and a short term increase in hypersecretion. Esomeprazole doses should be slowly lowered, or tapered, before discontinuing to prevent this rebound effect.
Molecule SMILES: COc1ccc2nc(S(=O)Cc3ncc(C)c(OC)c3C)[nH]c2c1

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: Esomeprazole is a Proton Pump Inhibitor. The mechanism of action of esomeprazole is as a Proton Pump Inhibitor, and Cytochrome P450 2C19 Inhibitor.
Molecule SMILES: COc1ccc2nc(S(=O)Cc3ncc(C)c(OC)c3C)[nH]c2c1

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: Esomeprazole Magnesium is the magnesium salt of esomeprazole, the S-isomer of omeprazole, with gastric proton pump inhibitor activity. In the acidic compartment of parietal cells, esomeprazole is protonated and converted into the active achiral sulphenamide; the active sulphenamide forms one or more covalent disulfide bonds with the proton pump hydrogen-potassium adenosine triphosphatase (H+/K+ ATPase), thereby inhibiting its activity and the parietal cell secretion of H+ ions into the gastric lumen, the final step in gastric acid production. H+/K+ ATPase is an integral membrane protein of the gastric parietal cell.
Molecule SMILES: COc1ccc2nc(S(=O)Cc3ncc(C)c(OC)c3C)[nH]c2c1

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: Esomeprazole is the S-isomer of omeprazole, with gastric proton pump inhibitor activity. In the acidic compartment of parietal cells, esomeprazole is protonated and converted into the active achiral sulfenamide; the active sulfenamide forms one or more covalent disulfide bonds with the proton pump hydrogen-potassium adenosine triphosphatase (H+/K+ ATPase), thereby inhibiting its activity and the parietal cell secretion of H+ ions into the gastric lumen, the final step in gastric acid production. H+/K+ ATPase is an integral membrane protein of the gastric parietal cell.
Molecule SMILES: COc1ccc2nc(S(=O)Cc3ncc(C)c(OC)c3C)[nH]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: Esomeprazole Sodium is the sodium salt of the S-isomer of omeprazole, with gastric proton pump inhibitor activity. In the acidic compartment of parietal cells, esomeprazole is protonated and converted into the active achiral sulfenamide; the active sulfenamide forms one or more covalent disulfide bonds with the proton pump hydrogen-potassium adenosine triphosphatase (H+/K+ ATPase), thereby inhibiting its activity and the parietal cell secretion of H+ ions into the gastric lumen, the final step in gastric acid production. H+/K+ ATPase is an integral membrane protein of the gastric parietal cell.
Molecule SMILES: COc1cc(Cl)c(OC)c(Oc2c(Cl)cc(O)cc2Cl)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: 3,5-Dichloro-4-(3-chloro-2,5-dimethoxyphenoxy)phenol is a natural product found in Russula subnigricans with data available.
Molecule SMILES: COc1cc(C(=O)OCC2OC(Oc3ccc(C4Oc5c(OC)cc(CCCO)cc5C4CO)cc3OC)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: Provide a brief overview of this molecule <molecule_2d> .

assistant: Saccharumoside A is a tannin. It has a role as a metabolite.
Molecule SMILES: O=C(O)c1ccccc1-n1cnc2ccccc2c1=O

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

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

assistant: 2-(4-oxoquinazolin-3-yl)benzoic Acid is a natural product found in Isatis tinctoria with data available.
Molecule SMILES: CCNC(=O)Nc1ccc2c(c1)C(=O)N(C)C1CCC(CC(=O)NC(C)c3ccccc3)OC1CO2

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: 2-[(2R,4aR,12aR)-8-(ethylcarbamoylamino)-5-methyl-6-oxo-2,3,4,4a,12,12a-hexahydropyrano[2,3-c][1,5]benzoxazocin-2-yl]-N-[(1R)-1-phenylethyl]acetamide is an aromatic ether.
Molecule SMILES: Cc1ccccc1-c1ccc2c(c1)OC(CN(C)Cc1ccc(C(=O)O)cc1)C(C)CN(C(C)CO)S2(=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: 4-[[[(4S,5S)-2-[(2S)-1-hydroxypropan-2-yl]-4-methyl-8-(2-methylphenyl)-1,1-dioxo-4,5-dihydro-3H-6,1$l^{6},2-benzoxathiazocin-5-yl]methyl-methylamino]methyl]benzoic acid is a member of benzoic acids.
Molecule SMILES: CC1=CC(O)CC(C)=CCC2(C)C(=O)C=C(C(C)C)C2CC1

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,6R,11R)-6-hydroxydolabella-3E,7E,12-trien-14-one is a natural product found in Stachybotrys chartarum with data available.
Molecule SMILES: O=C1CC(O)C(O)c2c(O)cccc21

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: (3S,4R)-3,4,5-trihydroxy-1-tetralone is a natural product found in Xylaria with data available.
Molecule SMILES: CCCCOC(=O)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: Given the molecule <molecule_2d>, what can you tell me about it?

assistant: N-butyl-p-hydroxybenzoate appears as odorless white crystals or crystalline powder. Tasteless, but numbs the tongue. Aqueous solutions slightly acidic to litmus. (NTP, 1992)
Molecule SMILES: CCCCOC(=O)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: I'd like a short overview about this molecule <molecule_2d>. Can you do that?

assistant: Butylparaben is an organic molecular entity.
Molecule SMILES: CCCCOC(=O)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: Could you give me a brief overview of this molecule <molecule_2d> ?

assistant: Butylparaben is a Standardized Chemical Allergen. The physiologic effect of butylparaben is by means of Increased Histamine Release, and Cell-mediated Immunity.
Molecule SMILES: CCCCOC(=O)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: Provide a brief overview of this molecule <molecule_2d> .

assistant: Butylparaben is a natural product found in Strychnos cathayensis and Carica papaya with data available.
Molecule SMILES: CCCCOC(=O)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: Could you give me a brief overview of this molecule <molecule_2d> ?

assistant: Butylparaben is a preservative and flavouring agent. Butylparaben has been shown to exhibit anti-microbial function  Butylparaben belongs to the family of Hydroxybenzoic Acid Derivatives. These are compounds containing an hydroxybenzoic acid (or a derivative), which is a benzene ring bearing a carboxylic acid. (A3205).
Molecule SMILES: CCCCCCC=CCCCCCCCCCCC

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: Nonadec-7-ene is a natural product found in Bombus consobrinus and Bombus hortorum with data available.
Molecule SMILES: COCC(O)(CCC(C)=C(C)C)C1Cc2cc(C(N)=O)ccc2N1

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: Benzastatin E is a natural product found in Streptomyces nitrosporeus with data available.