IDEA-AI4S/PubChemSFT huggingface dataset:
Molecule SMILES: CC1=CC2OC3C(O)CC(C)(C34CO4)C2(CO)C(O)C1=O

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

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

assistant: Deoxynivalenol is found in cereals and cereal products. Deoxynivalenol is produced by Fusarium graminearum and Fusarium roseum, responsible for headblight in cereals Vomitoxin, also known as deoxynivalenol (DON), is a type B trichothecene, an epoxy-sesquiterpeneoid. This mycotoxin occurs predominantly in grains such as wheat, barley, oats, rye, and maize, and less often in rice, sorghum, and triticale. The occurrence of deoxynivalenol is associated primarily with Fusarium graminearum (Gibberella zeae) and F. culmorum, both of which are important plant pathogens which cause Fusarium head blight in wheat and Gibberella ear rot in maize. Deoxynivalenol is a direct relationship between the incidence of Fusarium head blight and contamination of wheat with deoxynivalenol has been established. The incidence of Fusarium head blight is strongly associated with moisture at the time of flowering (anthesis), and the timing of rainfall, rather than the amount, is the most critical factor. Furthermore, deoxynivalenol contents are significantly affected by the susceptibility of cultivars towards Fusarium species, previous crop, tillage practices, and fungicide use

Deoxynivalenol belongs to the family of Trichothecenes. These are sesquiterpene mycotoxins structurally characterized by the presence of an epoxide ring and a benzoyran derivative with a variant number of hydroxyl, acetly, or other substituents [1]. (Reference: [1] http://www.inchem.org/documents/ehc/ehc/ehc105.htm).
Molecule SMILES: CC1(C)C(=O)C=CC2(C)C3CCC4(C)C(C5COC(=O)C5)CCC4(C)C3=CCC12

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: (4S)-4-[(5R,9R,10R,13S,14S,17S)-4,4,10,13,14-pentamethyl-3-oxo-5,6,9,11,12,15,16,17-octahydrocyclopenta[a]phenanthren-17-yl]oxolan-2-one is a natural product found in Aphanamixis grandifolia and Aphanamixis polystachya with data available.
Molecule SMILES: NC(C(=O)[O-])C(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: Describe this molecule: <molecule_2d> .

assistant: 3-hydroxy-L-glutamate(2-) is a doubly-charged L-alpha-amino acid anion resulting from deprotonation of both carboxy groups of 3-hydroxy-L-glutamic acid. It is a L-alpha-amino acid anion and a dicarboxylic acid dianion. It is functionally related to a L-glutamate(2-). It is a conjugate base of a 3-hydroxy-L-glutamate(1-).
Molecule SMILES: C=C(C(=O)OC1CC2(C)C(O)CCC(C=O)C2C2OC(=O)C(=C)C12)C(O)COC(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 provide a description of this molecule <molecule_2d> ?

assistant: (R)-4-Acetoxy-3-hydroxy-2-methylenebutyric acid [(3aR,3abeta,4S,9abeta,9balpha)-2-oxo-3-methylene-5aalpha-methyl-6alpha-hydroxy-9alpha-formyldodecahydronaphtho[1,2-b]furan]-4beta-yl ester is a natural product found in Centaurea spinosa with data available.
Molecule SMILES: CCCCCC(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: (2S)-2-heptanol is a secondary alcohol that is heptane substituted by a hydroxy group at position 2 (the 2S-stereoisomer). It has a role as a metabolite. It is a secondary alcohol, a fatty alcohol and a secondary fatty alcohol.
Molecule SMILES: CCCCCC(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: (S)-(+)-2-Heptanol is a natural product found in Aframomum melegueta and Zingiber officinale with data available.
Molecule SMILES: COc1cc2c(cc1O)-c1c(OC)c(O)cc3c1C(C2)NCC3

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: Laetanine is a natural product found in Ocotea teleiandra, Lindera glauca, and Hazomalania voyronii with data available.
Molecule SMILES: O=C(CC1CCC2C(COCC(O)CN2C(=O)Nc2cc(Cl)cc(Cl)c2)O1)N1CCOCC1

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: (3R,6aR,8R,10aR)-N-(3,5-dichlorophenyl)-3-hydroxy-8-[2-(4-morpholinyl)-2-oxoethyl]-3,4,6,6a,8,9,10,10a-octahydro-2H-pyrano[2,3-c][1,5]oxazocine-1-carboxamide is a member of ureas.
Molecule SMILES: COc1cc(CCc2cccc(O)c2)c(Cc2ccc(O)cc2)c(O)c1Cc1ccc(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: Bulbocodin D is a natural product found in Pleione bulbocodioides, Bletilla formosana, and Gymnadenia conopsea with data available.
Molecule SMILES: Nc1ncnc2c1ncn2C1OC(COP(N)(=O)[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: Tell me something about this molecule: <molecule_2d>

assistant: Adenosine 5'-phosphoramidate(1-) is conjugate base of adenosine 5'-phosphoramidate; major species at pH 7.3. It is a conjugate base of an adenosine 5'-phosphoramidate.
Molecule SMILES: COC(=O)C1CCC2C3(C)CCCC(C)(C)C3CCC23COC(=O)C13

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: methyl (1R,4R,9R,10S,13S,14S)-5,5,9-trimethyl-15-oxo-16-oxatetracyclo[8.7.0.01,14.04,9]heptadecane-13-carboxylate is a natural product found in Dendrilla rosea with data available.
Molecule SMILES: C=CC(=O)Cc1ccc2c(c1)OCO2

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: 1-(1,3-Benzodioxol-5-yl)but-3-en-2-one is a natural product found in Sassafras albidum with data available.
Molecule SMILES: CN1C(=O)CC(=O)N(c2ccccc2)c2cc(Cl)ccc21

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: Clobazam is a benzodiazepine that is used as an anticonvulsant in the therapy of severe childhood epilepsy. Therapy with clobazam has not been associated with serum aminotransferase elevations, and clinically apparent liver injury from clobazam has yet to be reported and must be rare, if it occurs at all.
Molecule SMILES: CN1C(=O)CC(=O)N(c2ccccc2)c2cc(Cl)ccc21

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: Clobazam is 7-Chloro-1H-1,5-benzodiazepine-2,4(3H,5H)-dione in which the hydrogen attached to the nitrogen at position 1 is substituted by a methyl group, whilst that attached to the other nitrogen is substituted by a phenyl group. It is used for the short-term management of acute anxiety and as an adjunct in the treatment of epilepsy in association with other antiepileptics. It has a role as an anticonvulsant, an anxiolytic drug and a GABA modulator. It is a 1,4-benzodiazepinone and an organochlorine compound.
Molecule SMILES: CN1C(=O)CC(=O)N(c2ccccc2)c2cc(Cl)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: Clobazam belongs to the 1,5-benzodiazepine class of drugs and is expected to have a better side-effect profile compared to older 1,4-benzodiazepines. It has been marketed as an anxiolytic since 1975 and an anticonvulsant since 1984. The oral preparation was FDA approved on October 21, 2011. An oral suspension is expected to be available in 2013.
Molecule SMILES: CN1C(=O)CC(=O)N(c2ccccc2)c2cc(Cl)ccc21

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: Clobazam is a Benzodiazepine. The mechanism of action of clobazam is as a Cytochrome P450 2D6 Inhibitor, and Cytochrome P450 3A4 Inducer.
Molecule SMILES: CN1C(=O)CC(=O)N(c2ccccc2)c2cc(Cl)ccc21

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: Clobazam is a 1,5-benzodiazepine and partial gamma-aminobutyric acid (GABA) receptor agonist, with anxiolytic, sedative, and anticonvulsant activities. Clobazam binds to a specific site, distinct from the inhibitory neurotransmitter GABA binding site, on the benzodiazepine-GABA-A-chloride ionophore receptor complex located in the central nervous system (CNS). This binding causes an allosteric modification of the receptor and enhances the affinity of GABA to the receptor leading to an increase in the opening of chloride-channels. This leads to an increase in chloride ion conductance, neuronal hyperpolarization, inhibition of the action potential and a decrease in neuronal excitability.
Molecule SMILES: O=C(C=Cc1ccc(O)cc1)OC(C(=O)O)C(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: Could you provide a description of this molecule <molecule_2d> ?

assistant: Coutaric acid is a natural product found in Vitis vinifera with data available.
Molecule SMILES: COc1ccc(C(O)C(C)Oc2ccc(C3OC(c4ccc(OC(C)C(O)c5ccc6c(c5)OCO6)c(OC)c4)C(C)C3C)cc2OC)cc1OC

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,2R)-1-(1,3-benzodioxol-5-yl)-2-[4-[(2R,3S,4R,5S)-5-[4-[(1R,2R)-1-(3,4-dimethoxyphenyl)-1-hydroxypropan-2-yl]oxy-3-methoxyphenyl]-3,4-dimethyloxolan-2-yl]-2-methoxyphenoxy]propan-1-ol is a natural product found in Saururus cernuus and Saururus chinensis with data available.
Molecule SMILES: CCCCCCCCC=CCCCCCCCC(=O)NCCOP(=O)([O-])OCC(COC(=O)CCCCCCCCCCCCCCCC)OC(=O)CCCCCCCCCCCCCCCC

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-oleoyl-1,2-diheptadecanoyl-sn-glycero-3-phosphoethanolamine(1-) is an N-oleoylphosphatidylethanolamine(1-) in which the acyl groups at positions 1 and 2 are both specified as heptadecanoyl. It is functionally related to a margarate and an oleate. It is a conjugate base of a N-oleoyl-1,2-diheptadecanoyl-sn-glycero-3-phosphoethanolamine.
Molecule SMILES: Clc1cccc2cccnc12

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: 8-chloroquinoline is a member of quinolines and an organochlorine compound.
Molecule SMILES: CCCCCCC=CCCCCCCCCCc1cccc(OC)c1C(=O)OC

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: Methyl 2-heptadec-10-enyl-6-methoxybenzoate is a natural product found in Knema laurina with data available.
Molecule SMILES: OCC1OC(OC2(COC3(CO)OC(CO)C(O)C3O)OC(CO)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: Given the molecule <molecule_2d>, what can you tell me about it?

assistant: 1-kestose is a trisaccharide found in vegetables consisting of beta-D-fructofuranose having beta-D-fructofuranosyl and alpha-D-glucopyranosyl residues attached at the 1- and 2-positions respectively.
Molecule SMILES: OCC1OC(OC2(COC3(CO)OC(CO)C(O)C3O)OC(CO)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: <molecule_2d> The above is a compound. Could you please tell me something about it?

assistant: 1-Kestose is a natural product found in Taraxacum lapponicum, Arctium umbrosum, and other organisms with data available.
Molecule SMILES: COCC(=O)N1CC(O)CC1C(=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: N-(methoxyacetyl)-4-hydroxyproline is a 4-hydroxyproline substituted at N-1 by an methoxyacetyl group. It has a role as a metabolite. It is functionally related to a 4-hydroxyproline.
Molecule SMILES: C=C1C(OC(=O)C=Cc2ccccc2)CCC2(C)C(O)C(OC(C)=O)C34C(C)C(=O)CC(O)(C(OC(C)=O)C123)C4(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: [(1S,2R,3R,4R,7S,9R,10S,11S,14S)-2,10-diacetyloxy-3,11-dihydroxy-4,14,15,15-tetramethyl-8-methylidene-13-oxo-7-tetracyclo[9.3.1.01,9.04,9]pentadecanyl] (E)-3-phenylprop-2-enoate is a natural product found in Taxus baccata with data available.
Molecule SMILES: O=c1cc(-c2ccccc2)oc2cc(O)c(C3OC(CO)C(O)C(O)C3O)c(O)c12

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: chrysin 6-C-glucoside is a natural product found in Cyclanthera pedata with data available.
Molecule SMILES: COCC1OC(OC(=O)C23CCC(C)C(C)(O)C2C2=CCC4C5(C)CCC(O)C(C)(C(=O)O)C5CCC4(C)C2(C)CC3)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: 3beta,19-Dihydroxyurs-12-ene-24,28-dioic acid 28-(6-O-methyl-beta-D-glucopyranosyl) ester is a natural product found in Rubus pileatus with data available.
Molecule SMILES: CC(C)(O)C1CCC(Nc2ccc3ncc(-c4cccc(C(F)(F)F)c4)n3n2)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: PIM Kinase Inhibitor TP-3654 is an orally available, second-generation and selective ATP-competitive inhibitor of proviral integration site for Moloney murine leukemia virus (PIM) kinases, with potential antineoplastic activity. Upon oral administration, PIM kinase inhibitor TP-3654 selectively binds to and prevents the activation of the PIM kinases. This prevents the activation of PIM-mediated signaling pathways and inhibits proliferation in cells that overexpress PIM. PIMs, constitutively active proto-oncogenic serine/threonine kinases, are upregulated in various types of cancers and play key roles in tumor cell proliferation and survival.
Molecule SMILES: CC(C=CC=C(C)C(=O)OC1OC(COC2OC(CO)C(O)C(O)C2O)C(O)C(O)C1O)=CC=CC=C(C)C=CC=C(C)C(=O)OC1OC(COC2OC(CO)C(O)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: Describe this molecule: <molecule_2d> .

assistant: Crocetin digentiobiosyl ester is a natural product found in Crocus sativus with data available.
Molecule SMILES: O=C(O)CCCCCNC(=O)Cc1cc(Br)c(O)c([N+](=O)[O-])c1

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

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

assistant: 6-[(3-bromo-4-hydroxy-5-nitrophenyl)acetamido]caproic acid is an N-acylamino acid that consists of 6-aminohexanoic acid bearing an N-(3-bromo-4-hydroxy-5-nitrophenyl)acetyl substituent. It is a N-acyl-amino acid, an organobromine compound and a member of 2-nitrophenols. It is functionally related to a 6-aminohexanoic acid.
Molecule SMILES: CC(C)=C1CC2(C)C(=CC1=O)CCCC2C

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: 4a,5-dimethyl-3-propan-2-ylidene-5,6,7,8-tetrahydro-4H-naphthalen-2-one is a natural product found in Petasites hybridus, Arctium, and Cousinia with data available.
Molecule SMILES: COc1ccc(NC(=O)N(C)CC2OCc3ccccc3-c3c(n(C)c4ccccc34)C(=O)N(C(C)CO)CC2C)cc1

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-30652 is an indolyl carboxylic acid.
Molecule SMILES: C=CC1(C)CC(O)(C(O)C(=C)C)Oc2c1c(=O)oc1cccc(C)c21

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: (2R,4S)-4-ethenyl-2-hydroxy-2-[(1R)-1-hydroxy-2-methylprop-2-enyl]-4,10-dimethyl-3H-pyrano[3,2-c]chromen-5-one is a natural product found in Ethulia conyzoides with data available.
Molecule SMILES: COc1ccc2c(c1OC)CC(=O)N1CCc3cc4c(cc3C(=O)C21)OCO4

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: Puntarenine is a natural product found in Berberis darwinii and Berberis empetrifolia with data available.
Molecule SMILES: CC(C)C1=CC2=CC=C3C(C)(COC(=O)c4ccc(O)c(O)c4)CCCC3(C)C2=C(O)C1=O

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

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

assistant: Parviflorone E is a natural product found in Plectranthus parviflorus and Plectranthus strigosus with data available.
Molecule SMILES: CC1=C2N=C(C=C3N=C(C(C)=C4[N-]C(C(CC(=O)[O-])C4(C)CCC(=O)[O-])C4(C)N=C1C(CCC(=O)[O-])C4(C)CC(=O)[O-])C(CCC(=O)[O-])C3(C)C)C(CCC(=O)[O-])C2(C)CC(N)=O.[Co]

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: Cob(II)yrinate c monoamide(5-) is a precorrin carboxylic acid anion obtained by global deprotonation of the carboxy groups of cob(II)yrinic acid c monoamide. It is a conjugate base of a cob(II)yrinic acid c monoamide.
Molecule SMILES: COc1cc(C(CO)COC2OC(CO)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: Describe this molecule: <molecule_2d> .

assistant: Junipediol A 8-glucoside is a glycoside.
Molecule SMILES: O=CC=CC(O)COP(=O)([O-])[O-]

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

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

assistant: (2E,4S)-4-hydroxypenten-2-al-5-phosphate(2-) is major species at pH 7.3
Molecule SMILES: CCCCCCCCCCCCCCCCC(CCCCCC)CCCCCCC(=O)OC

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: methyl (8S)-8-hexyltetracosanoate is a natural product found in Hygrophila auriculata and Hygrophila schulli with data available.
Molecule SMILES: CC(C)C1CCC2(C)C3CCC(C=O)C(O3)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: Saniculamoid A, rel- is a sesquiterpenoid. It has a role as a metabolite.
Molecule SMILES: CC(C)C1CCC2(C)C3CCC(C=O)C(O3)C12

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: Saniculamoid A, rel- is a natural product found in Sanicula lamelligera with data available.
Molecule SMILES: CC=C(CCC(C)C1CCC2C3=CCC4C(C)C(OC(C)=O)CCC4(C)C3CCC21C)C(C)C

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

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

assistant: [(3S,4S,5S,9R,10S,13R,14R,17R)-4,10,13-trimethyl-17-[(E,2R)-5-propan-2-ylhept-5-en-2-yl]-2,3,4,5,6,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl] acetate is a natural product found in Phaseolus vulgaris with data available.
Molecule SMILES: CC1CC(=O)N2CCCc3oc1cc(=O)c3CCC2

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: Huperzine P is a natural product found in Huperzia serrata with data available.
Molecule SMILES: COc1ccc2c3c1OC1C(O)C=CC4C(C2)N(C)CCC341.O=P(O)(O)O

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

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

assistant: Codeine phosphate appears as colorless small crystals or white powder. Odorless. Bitter taste. Solutions are acid to litmus. pH (4% solution) 4.2-5. (NTP, 1992)
Molecule SMILES: COc1ccc2c3c1OC1C(O)C=CC4C(C2)N(C)CCC341.O=P(O)(O)O

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

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

assistant: Codeine Phosphate is the phosphate salt of codeine, a naturally occurring phenanthrene alkaloid and opioid agonist with analgesic, antidiarrheal and antitussive activities. Codeine mimics the actions of endogenous opioids by binding to the opioid receptors at many sites within the central nervous system (CNS). Stimulation of mu-subtype opioid receptors results in a decrease in the release of nociceptive neurotransmitters such as substance P, GABA, dopamine, acetylcholine and noradrenaline; in addition, the codeine metabolite morphine induces opening of G-protein-coupled inwardly rectifying potassium (GIRK) channels and blocks the opening of N-type voltage-gated calcium channels, resulting in hyperpolarization and reduced neuronal excitability. Stimulation of gut mu-subtype opioid receptors results in a reduction in intestinal motility and delayed intestinal transit times. Antitussive activity is mediated through codeine's action on the cough center in the medulla.
Molecule SMILES: CNC(=O)ON=CC(C)(C)CCC#N.Cl[Zn]Cl

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: Zinc, dichloro(4,4-dimethyl-5((((methylamino) carbonyl)oxy)imino)pentanenitrile)-,(t-4)- appears as a solid. (EPA, 1998)
Molecule SMILES: COc1ccccc1OCCNC(=O)c1cc(=O)[nH]c2ccccc12

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

user: Provide a description of this molecule <molecule_2d> .

assistant: N-[2-(2-Methoxyphenoxy)ethyl]-2-oxo-1H-quinoline-4-carboxamide is a member of quinolines. It has a role as an anticoronaviral agent.