IDEA-AI4S/PubChemSFT huggingface dataset:
Molecule SMILES: [O-][Cl+2]([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: Chloric acid is a colorless liquid. It will accelerate the burning of combustible materials and can ignite most on contact. It is corrosive to metals and tissue. It is used as a reagent in chemical analysis and to make other chemicals.
Molecule SMILES: [O-][Cl+2]([O-])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: Chloric acid is a chlorine oxoacid. It is a conjugate acid of a chlorate.
Molecule SMILES: O=C=NC1CCCCC1

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

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

assistant: Cyclohexyl isocyanate appears as a yellowish liquid with an irritating odor. Insoluble in water. Flash point 127 °F. Very toxic by inhalation, skin absorption and ingestion. Used to make pharmaceuticals and agricultural chemicals.
Molecule SMILES: O=C=NC1CCCCC1

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

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

assistant: Cyclohexyl isocyanate is an isocyanate comprising a cyclohexane core with a single isocyanato substituent. It has a role as an allergen.
Molecule SMILES: C=C1C(=O)C23CCC4C(C)(CO)CCCC4(C)C2C(OC(C)=O)CC1(O)C3

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: Rosthornin A is a natural product found in Isodon pharicus and Isodon rosthornii with data available.
Molecule SMILES: CC(C)=CC1CC(C)(OC2OCC(O)C(O)C2O)C2C3CCC4C5(C)CCC(OC6OCC(O)C(O)C6O)C(C)(C)C5CCC4(C)C34COC2(C4)O1

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: (2S,3R,4S,5S)-2-[[(1S,2R,5R,7S,10R,11R,14R,15S,16S,18R,20S)-2,6,6,10,16-pentamethyl-18-(2-methylprop-1-enyl)-16-[(2S,3R,4S,5S)-3,4,5-trihydroxyoxan-2-yl]oxy-19,21-dioxahexacyclo[18.2.1.01,14.02,11.05,10.015,20]tricosan-7-yl]oxy]oxane-3,4,5-triol is a natural product found in Bacopa monnieri with data available.
Molecule SMILES: COC(=O)C(C)CCC1C(C)=C(C)CCC1(C)COc1ccc2ccc(=O)oc2c1

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: methyl (2R)-2-methyl-4-[(1R,6R)-2,3,6-trimethyl-6-[(2-oxochromen-7-yl)oxymethyl]cyclohex-2-en-1-yl]butanoate is a natural product found in Ferula assa-foetida with data available.
Molecule SMILES: CCCC(=O)OC1CC2(C)C(C=C(C)C(OC(C)=O)C(O)C2OC(=O)CCC)C2C(C(C)C)C(OC(C)=O)CC12C

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,2S,3aR,4S,5aR,6S,7S,8S,10aS,10bR)-2,8-diacetyloxy-6-butanoyloxy-7-hydroxy-3a,5a,9-trimethyl-1-propan-2-yl-1,2,3,4,5,6,7,8,10a,10b-decahydrocyclohepta[e]inden-4-yl] butanoate is a natural product found in Phorbas with data available.
Molecule SMILES: C=C1C(=O)OC2C=C(C)CCC=C(C)C(OC(C)=O)C(OC(=O)C3(C)OC3C)C12

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

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

assistant: [(3aR,4S,5S,6Z,10Z,11aS)-5-acetyloxy-6,10-dimethyl-3-methylidene-2-oxo-3a,4,5,8,9,11a-hexahydrocyclodeca[b]furan-4-yl] (2R,3R)-2,3-dimethyloxirane-2-carboxylate is a natural product found in Montanoa hibiscifolia with data available.
Molecule SMILES: CC(C)=CCCC(C)(O)C1CCC2(C)C1C(O)CC1C3(C)CCC(O)C(C)(C)C3C(OC3OC(CO)C(O)C(O)C3OC3OC(C)C(O)C(O)C3O)CC12C

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: 20(S)-Ginsenoside Rg2 is a natural product found in Panax ginseng with data available.
Molecule SMILES: O=CCCC=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: Succinic aldehyde is an aldehyde.
Molecule SMILES: O=CCCC=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: Succinaldehyde is a natural product found in Phaseolus vulgaris with data available.
Molecule SMILES: COC1C=CC=C(C)C(=O)Nc2ccc(O)c(c2)CC(C)CC(OC)C(O)C(C)C=C(C)C1OC(N)=O

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

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

assistant: Carbamic acid (4E,6Z,10E)-(8S,9S,12S,13R,14S,16R)-13,19-dihydroxy-8,14-dimethoxy-4,10,12,16-tetramethyl-3-oxo-2-aza-bicyclo[16.3.1]docosa-1(22),4,6,10,18,20-hexaen-9-yl ester is a natural product found in Streptomyces hygroscopicus with data available.
Molecule SMILES: C=CC(C)=CCCC(C)=Cc1cc(C(=O)O)co1

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-(2,6-Dimethyl-1,5,7-octatriene-1-yl)furan-4-carboxylic acid is a natural product found in Sinularia capillosa with data available.
Molecule SMILES: CC(=O)OCC12C(OC(C)=O)C(=O)C3C(O)C14OC3(C)COC(=O)c1cccnc1C(C)C(C)C(=O)OC(C(OC(C)=O)C2O)C4(C)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: [(1S,3R,13S,14R,17S,18R,19R,20S,21S,23R,24R,25S)-18,21-diacetyloxy-19,24,25-trihydroxy-3,13,14,25-tetramethyl-6,15,22-trioxo-2,5,16-trioxa-11-azapentacyclo[15.7.1.01,20.03,23.07,12]pentacosa-7(12),8,10-trien-20-yl]methyl acetate is a natural product found in Euonymus europaeus with data available.
Molecule SMILES: CC(N)C(=O)NC(CC(=O)O)C(=O)O

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

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

assistant: Ala-Asp is a dipeptide formed from L-alanyl and L-aspartic acid residues. It has a role as a metabolite. It is a conjugate acid of an Ala-Asp(1-).
Molecule SMILES: CC(N)C(=O)NC(CC(=O)O)C(=O)O

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

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

assistant: Ala-asp is a natural product found in Arabidopsis thaliana and Trypanosoma brucei with data available.
Molecule SMILES: CC(C)(COP(=O)(O)OP(=O)(O)OCC1OC(n2cnc3c(N)ncnc32)C(O)C1OP(=O)(O)O)C(O)C(=O)NCCC(=O)NCCSC(=O)C(=O)c1ccccc1

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: Phenylglyoxylyl-CoA is an acyl-CoA that results from the formal condensation of the thiol group of coenzyme A with the carboxy group of phenylglyoxylic acid. It is functionally related to a coenzyme A and a phenylglyoxylic acid. It is a conjugate acid of a phenylglyoxylyl-CoA(4-).
Molecule SMILES: CC(=O)NC1C(O)OC(CO)C(OC2OC(CO)C(OC3OC(COC4OC(CO)C(O)C(O)C4OC4OC(CO)C(OC5OC(COC6(C(=O)O)CC(O)C(NC(C)=O)C(C(O)C(O)CO)O6)C(O)C(O)C5O)C(O)C4NC(C)=O)C(O)C(OC4OC(CO)C(OC5OC(CO)C(OC6OC(CO)C(O)C(O)C6O)C(OC6OC(C)C(O)C(O)C6O)C5NC(C)=O)C(O)C4OC4OC(CO)C(OC5OC(COC6(C(=O)O)CC(O)C(NC(C)=O)C(C(O)C(O)CO)O6)C(O)C(O)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: Given the molecule <molecule_2d>, what can you tell me about it?

assistant: CID 91858184 is a polysaccharide.
Molecule SMILES: COc1ccc(C=NNC(=O)c2nc(-c3ccccc3)cc(-c3ccccc3)n2)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: N-[(3-hydroxy-4-methoxyphenyl)methylideneamino]-4,6-diphenyl-2-pyrimidinecarboxamide is a member of pyrimidines.
Molecule SMILES: N=C1N(O)C(COC(N)=O)C2N=C(N)NC23N1CC(OS(=O)(=O)O)C3(O)O

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

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

assistant: Gonyautoxin IV is a natural product found in Aphanizomenon, Gonyaulax, and other organisms with data available.
Molecule SMILES: CC=C(C=O)C(CC=O)CC(=O)O

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

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

assistant: 4-Formyl-3-(formylmethyl)-4-hexenoic acid is a medium-chain fatty acid.
Molecule SMILES: CN(C)c1ncnc2c1ncn2C1OC(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: Tell me something about this molecule: <molecule_2d>

assistant: N(6),N(6)-dimethyladenosine is a methyladenosine compound with two methyl groups attached to N(6) of the adenine nucleobase. It is functionally related to an adenosine.
Molecule SMILES: CC1=C2CC3(O)C(C)CCC3C(C)(O)C=C2OC1=O

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

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

assistant: (5S,5aS,8R,8aS)-5,8a-dihydroxy-1,5,8-trimethyl-6,7,8,9-tetrahydro-5aH-azuleno[6,5-b]furan-2-one is a natural product found in Curcuma phaeocaulis with data available.
Molecule SMILES: COc1ccc(C=CN2C(=O)NC(CCCN=C(N)N)C2=O)cc1Br

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-[1-[2-(3-Bromo-4-methoxyphenyl)ethenyl]-2,5-dioxoimidazolidin-4-yl]propyl]guanidine is a natural product found in Axinella damicornis with data available.
Molecule SMILES: CCCCCCCCCC(=O)OC1CCC2(C)C(=CCC3C2CCC2(C)C(c4cccnc4)=CCC32)C1

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: Abiraterone Decanoate is the decanoate form of abiraterone, a steroidal compound with antiandrogen activity. Abiraterone inhibits the enzymatic activity of steroid 17alpha-monooxygenase (17alpha-hydrolase/C17,20 lyase complex; CYP17A1), a member of the cytochrome p450 family that catalyzes the 17alpha-hydroxylation of steroid intermediates involved in testosterone synthesis. Administration of this agent may suppress testosterone production by both the testes and the adrenals to castrate-range levels.
Molecule SMILES: CCc1[nH]cc(C)c1C(=O)OC(C)C1=CCC23OCCN(C)CC12CC(O)C12OC4(O)CCC1(C)C(CC=C32)C4

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: Homobatrachotoxin is a member of pyrroles.
Molecule SMILES: CCc1[nH]cc(C)c1C(=O)OC(C)C1=CCC23OCCN(C)CC12CC(O)C12OC4(O)CCC1(C)C(CC=C32)C4

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: Homobatrachotoxin is a natural product found in Phyllobates aurotaenia, Pitohui kirhocephalus, and Pseudorectes ferrugineus with data available.
Molecule SMILES: COC(=O)CC(Nc1ccc(C=O)cc1)C(O)C=CC(C)O

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

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

assistant: (E)-3-(4-Formylanilino)-4,7-dihydroxy-5-octenoic acid methyl ester is a natural product found in Streptomyces viridochromogenes with data available.
Molecule SMILES: CC(=CCN1CN(C)c2ncnc(N)c21)CCC1(C)C(C)CCC2(C)C(CO)=CCCC21

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: [5-[5-(6-amino-9-methyl-8H-purin-7-yl)-3-methylpent-3-enyl]-5,6,8a-trimethyl-3,4,4a,6,7,8-hexahydronaphthalen-1-yl]methanol is a natural product found in Agelas with data available.
Molecule SMILES: CC1OC(OC2CCC3(C)C(CCC4C3CC(O)C3(C)C(C5=CCOC5=O)CCC43O)C2)CC(O)C1OC1CC(O)C(OC2CC(O)C(OC3OC(CO)C(O)C(O)C3O)C(C)O2)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: Could you provide a description of this molecule <molecule_2d> ?

assistant: 4-[(3S,5R,8R,9S,10S,12R,13S,14S,17R)-12,14-dihydroxy-3-[(2R,4S,5S,6R)-4-hydroxy-5-[(2S,4S,5S,6R)-4-hydroxy-5-[(2S,4S,5S,6R)-4-hydroxy-6-methyl-5-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-6-methyloxan-2-yl]oxy-6-methyloxan-2-yl]oxy-10,13-dimethyl-1,2,3,4,5,6,7,8,9,11,12,15,16,17-tetradecahydrocyclopenta[a]phenanthren-17-yl]-2H-furan-5-one is a natural product found in Digitalis parviflora, Digitalis viridiflora, and Digitalis purpurea with data available.
Molecule SMILES: CCC1OC(C2(C)CC(C)C(O)(C3(C)CCC(C(O)C4(O)OC(CC5(O)OC(C(C)C(O)CC6CCC(C)C(C(C)C(=O)O)O6)CCC5C)C(C)CC4C)O3)O2)CCC1(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: Desmethylalborixin is a natural product found in Streptomyces with data available.
Molecule SMILES: CC1CCCC2(C)CC3OOC12C=C3C(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: Given the molecule <molecule_2d>, what can you tell me about it?

assistant: 5beta,8beta-Epidioxy-11-hydroxy-6-eudesmene is a natural product found in Litophyton erectum with data available.
Molecule SMILES: CCC=CCC=CCC=CCC=CCC=CCC=CCCC(=O)OCC(COP(=O)(O)OCC(N)C(=O)O)OC(=O)CCCCCCCCCCCCCCC

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: PS(22:6(4Z,7Z,10Z,13Z,16Z,19Z)/16:0) is a natural product found in Lysiphlebia japonica and Aphis gossypii with data available.
Molecule SMILES: C=CC1C(OC(=O)c2ccccc2)C2C(O)(C(=O)C1(C)O)C(OC(C)=O)CC1C(C)(C)C(OC(C)=O)C(O)C(OC(=O)c3ccccc3)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: (7,10-diacetyloxy-5-benzoyloxy-3-ethenyl-2,6,10a-trihydroxy-2,4b,8,8-tetramethyl-1-oxo-4,4a,5,6,7,8a,9,10-octahydro-3H-phenanthren-4-yl) benzoate is a natural product found in Orthosiphon aristatus with data available.
Molecule SMILES: CC1(C)CCC2(C(=O)OC3OC(CO)C(O)C(O)C3O)CCC3(C)C(=CCC4C5(C)CCC(OC(=O)C6OC(O)C(O)C(O)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: Provide a brief overview of this molecule <molecule_2d> .

assistant: [(3S,4R,4aR,6aR,6bS,8aS,12aR,14aR,14bR)-4-(hydroxymethyl)-4,6a,6b,11,11,14b-hexamethyl-8a-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxycarbonyl-1,2,3,4a,5,6,7,8,9,10,12,12a,14,14a-tetradecahydropicen-3-yl] (2S,3S,4S,5R,6R)-3,4,5,6-tetrahydroxyoxane-2-carboxylate is a natural product found in Ilex rotunda with data available.
Molecule SMILES: C=C1C(=O)OC2CC(CO)CCC=C(C(=O)OC)CC(OC(=O)C(C)CC)C12

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: Melnerin B is a natural product found in Melampodium cinereum with data available.
Molecule SMILES: CC(=O)OCC12CC(O)C(C)=CC1OC1C(O)C(OC(C)=O)C2(C)C12CO2

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: [(2R,4S,10R,11S)-11-acetyloxy-4,10-dihydroxy-1,5-dimethylspiro[8-oxatricyclo[7.2.1.02,7]dodec-5-ene-12,2'-oxirane]-2-yl]methyl acetate is a natural product found in Fusarium sambucinum, Fusarium sporotrichioides, and other organisms with data available.
Molecule SMILES: CC1=CCC2(CC1)C(C)CCC2C(C)(C)O

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

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

assistant: 2-(1,8-Dimethylspiro[4.5]dec-8-en-4-yl)propan-2-ol is a natural product found in Santalum album with data available.
Molecule SMILES: CCC(=O)OC(C)(C)C1CC=C(C)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: Alpha-Terpineol propanoate is a p-menthane monoterpenoid.
Molecule SMILES: O=S1(=O)CCOCC1

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: 1,4Lambda~6~-oxathiane-4,4-dione is an oxacycle and an organosulfur heterocyclic compound.
Molecule SMILES: C=CC1(C)CCC2=C(CCC3C2(C)CC(=O)C(O)C3(C)C)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: 7-Ethenyl-2-hydroxy-1,1,4a,7-tetramethyl-2,4,5,6,8,9,10,10a-octahydrophenanthren-3-one is a natural product found in Micromonospora cinerea with data available.
Molecule SMILES: CCCC=C(C)C(C)=O

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

user: Describe this molecule: <molecule_2d> .

assistant: 3-Methylhept-3-en-2-one is a natural product found in Glycyrrhiza glabra with data available.
Molecule SMILES: C=CC1C(OC2OC(CO)C(O)C(O)C2O)OC=C(C(=O)OC)C1C(=O)c1nccc2c1[nH]c1ccccc12

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: Isopauridianthoside is a natural product found in Pauridiantha paucinervis and Pauridiantha lyallii with data available.
Molecule SMILES: CC(C)=CCCC1(C)C=Cc2c(ccc3c2[nH]c2cc(O)c(C)cc23)O1

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

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

assistant: 3,8-Dimethyl-3-(4-methylpent-3-en-1-yl)-3,11-dihydropyrano[3,2-a]carbazol-9-ol is a natural product found in Murraya euchrestifolia, Murraya koenigii, and Murraya kwangsiensis with data available.
Molecule SMILES: CNC(=O)Oc1ccccc1OC(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: Propoxur is a white to tan crystalline powder with a faint, characteristic odor. Used as an insecticide. (NIOSH, 2022)
Molecule SMILES: CNC(=O)Oc1ccccc1OC(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: Propoxur is a carbamate ester that is phenyl methylcarbamate substituted at position 2 by a propan-2-yloxy group. It has a role as an EC 3.1.1.7 (acetylcholinesterase) inhibitor, a carbamate insecticide, an acaricide and an agrochemical. It is a carbamate ester and an aromatic ether. It is functionally related to a methylcarbamic acid and a 2-isopropoxyphenol.
Molecule SMILES: CNC(=O)Oc1ccccc1OC(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: Propoxur is an insecticide used to control cockroaches, flies, mosquitoes, and lawn and turf insects. Acute (short-term) exposure of humans to propoxur by ingestion leads to cholinesterase inhibition of red blood cells, with mild cholinergic symptoms including blurred vision, nausea, vomiting, sweating, and tachycardia; however, the effects are transient. Chronic (long-term) inhalation exposure has resulted in depressed cholinesterase levels, headaches, vomiting, and nausea in humans. Chronic ingestion studies in animals have reported depressed cholinesterase levels, depressed body weight, effects to the liver and bladder, and a slight increase in neuropathy. No information is available on the reproductive, developmental, or carcinogenic effects of propoxur in humans. Mixed results are available from cancer studies of propoxur in animals. EPA has not classified propoxur for carcinogenicity.
Molecule SMILES: CNC(=O)Oc1ccccc1OC(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 brief overview of this molecule <molecule_2d> .

assistant: Propoxur is a synthetic carbamate, aromatic ether compound, and acetylcholinesterase inhibitor that is used as a pesticide. It is characterized as a toxic, white to tan crystalline solid with a faint odor, and exposure occurs by inhalation, ingestion, or contact.
Molecule SMILES: CNC(=O)Oc1ccccc1OC(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 provide a description of this molecule <molecule_2d> ?

assistant: Propoxur is a carbamate pesticide. Carbamate pesticides are derived from carbamic acid and kill insects in a similar fashion as organophosphate insecticides. They are widely used in homes, gardens and agriculture. The first carbamate, carbaryl, was introduced in 1956 and more of it has been used throughout the world than all other carbamates combined. Because of carbaryl's relatively low mammalian oral and dermal toxicity and broad control spectrum, it has had wide use in lawn and garden settings. Most of the carbamates are extremely toxic to Hymenoptera, and precautions must be taken to avoid exposure to foraging bees or parasitic wasps. Some of the carbamates are translocated within plants, making them an effective systemic treatment. (L795)
Molecule SMILES: CC(=O)OC(C)C1C(C)(O)CC(=O)C23OC12C(O)=c1ccc(=c2ccc4c(=O)c5c(=C(C)O)c(C)cc(=O)c=5c(=O)c=4c2=O)c(O)c1C3O

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: Julichrome Q3-5 is a natural product found in Streptomyces with data available.