IDEA-AI4S/PubChemSFT huggingface dataset:
Molecule SMILES: CC1CCC2C(C)(C)C(O)C3(C)CCC12C3

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: (1R,2R,5R,7R,8S)-2,6,6,8-tetramethyltricyclo[6.2.1.01,5]undecan-7-ol is a natural product found in Juniperus thurifera and Fabiana imbricata with data available.
Molecule SMILES: COc1cc2ccc(=O)oc2c(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assistant: Fraxetin is a hydroxycoumarin that is 6-methoxycoumarin in which the hydrogens at positions 7 and 8 have been replaced by hydroxy groups. It has a role as an Arabidopsis thaliana metabolite, an antimicrobial agent, an apoptosis inhibitor, an apoptosis inducer, an antioxidant, an anti-inflammatory agent, a hepatoprotective agent, an antibacterial agent and a hypoglycemic agent. It is a hydroxycoumarin and an aromatic ether.
Molecule SMILES: COc1cc2ccc(=O)oc2c(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: Fraxetin is a natural product found in Santolina pinnata, Campanula dolomitica, and other organisms with data available.
Molecule SMILES: Cc1ccc(C(C)CCC(=O)C(C)C)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: <molecule_2d> The above is a compound. Could you please tell me something about it?

assistant: (6R)-6-(2-hydroxy-4-methylphenyl)-2-methylheptan-3-one is a natural product found in Juniperus chinensis with data available.
Molecule SMILES: CCOP(=S)(OCC)Oc1cc(C)nc(N(CC)CC)n1

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: Straw colored liquid. Used as a pesticide. (EPA, 1998)
Molecule SMILES: CCOP(=S)(OCC)Oc1cc(C)nc(N(CC)CC)n1

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: Pirimiphos-ethyl is an organic thiophosphate.
Molecule SMILES: CC1(C)CCC(C(C)(O)C2CCC3(O)C4=CC(=O)C5CC(O)C(O)CC5(C)C4CCC23C)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: 5beta,20xi-Cholest-7-en-6-one, 22,25-epoxy-2beta,3beta,14,20-tetrahydroxy- is a natural product found in Silene chalcedonica with data available.
Molecule SMILES: CC(CO)C1C(O)C(O)C2=CC3=C(CO)CCCC3(C)CCC21C

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: Radianspene D is a natural product found in Coprinellus radians with data available.
Molecule SMILES: C=C(C(=O)O)C1C=C2C(C)CCCC2(C)C(OC2OC(CO)C(O)C(O)C2O)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 description of this molecule <molecule_2d> .

assistant: Pterodontoside B is a natural product found in Laggera pterodonta and Laggera crispata with data available.
Molecule SMILES: CC#CC#CC=CC(=O)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: Provide a description of this molecule <molecule_2d> .

assistant: (9E)-Pentadecane-9-ene-11,13-diyne-2,8-dione is a natural product found in Echinacea pallida with data available.
Molecule SMILES: CC1=C2CC(C)(C)C(O)C2CC2(C)CCC12O

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: Sddddljocmwsoq-nebzkdrisa- is a natural product found in Phlebia tremellosa with data available.
Molecule SMILES: O.O.[C-]#N.[C-]#N.[C-]#N.[C-]#N.[C-]#N.[Fe+4].[N-]=O.[Na+].[Na+]

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: Sodium nitroprusside dihydrate is a hydrate that is the dihydrate form of sodium nitroprusside. It has a role as a nitric oxide donor and a vasodilator agent. It contains a sodium nitroprusside.
Molecule SMILES: COc1ccc(C#Cc2ccc(C3C(CO)N4C(=O)CN(C(=O)c5ccc(F)cc5)CC34)cc2)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: (6R,7R,8S)-4-[(4-fluorophenyl)-oxomethyl]-8-(hydroxymethyl)-7-[4-[2-(4-methoxyphenyl)ethynyl]phenyl]-1,4-diazabicyclo[4.2.0]octan-2-one is a member of azetidines, a member of benzenes and a ring assembly.
Molecule SMILES: COC1C(OC2C(OC3C(O)C(CO)OC(O)C3NC(C)=O)OC(CO)C(O)C2O)OC(C)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: Please give me some details about this molecule <molecule_2d> .

assistant: Alpha-L-Fucp2Me-(1->2)-beta-D-Galp-(1->3)-beta-D-GalpNAc is an amino trisaccharide consisting of a 2-O-methyl-L-fucosyl residue at the non-reducing end linked (1->2) to an beta-D-galactosyl residue which is in turn linked (1->3) to an N-acetyl-beta-D-galactosamine.
Molecule SMILES: COC(C(=O)C(O)C(C)O)C1Cc2cc3cc(O)cc(O)c3c(O)c2C(=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: Olivin is a decaketide, a secondary alpha-hydroxy ketone and an anthracenone. It has a role as a metabolite.
Molecule SMILES: COC(C(=O)C(O)C(C)O)C1Cc2cc3cc(O)cc(O)c3c(O)c2C(=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: Olivin is a natural product found in Olea europaea with data available.
Molecule SMILES: CC(Oc1ccc(Oc2ncc(C(F)(F)F)cc2Cl)cc1)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: I'd like a short overview about this molecule <molecule_2d>. Can you do that?

assistant: (S)-haloxyfop(1-) is a monocarboxylic acid anion resulting from deprotonation of the carboxy group of (S)-haloxyfop. It is a conjugate base of a (S)-haloxyfop. It is an enantiomer of a haloxyfop-P(1-).
Molecule SMILES: CCC(O)CCC(=O)O

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

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

assistant: DL-4-hydroxy caproic acid is a carbonyl compound.
Molecule SMILES: CC(C)N(C(=O)SCC(Cl)=CCl)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: Diallat is a tertiary amine.
Molecule SMILES: CC(C)N(C(=O)SCC(Cl)=CCl)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: Diallate is a thiocarbamate herbicide used to control weeds and grasses amongst crops. It can be applied to the soil before planting or to the growing crops. It is used on alfalfa, alsike clover, barley, corn, flax, soybeans, lentils, peas, potatoes, red clover, sugar beets and sweet clover. Thiocarbamates are mainly used in agriculture as insecticides, herbicides, and fungicides.  Additional uses are as biocides for industrial or other commercial applications, and in household products.  Some are used for vector control in public health. Thiocarbamates are mostly liquids or solids with low melting points.
Molecule SMILES: CC1CCC=C2CC(O)C(C(C)(C)O)CC21C

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,3S,4aS,5R)-3-(2-hydroxypropan-2-yl)-4a,5-dimethyl-2,3,4,5,6,7-hexahydro-1H-naphthalen-2-ol is a natural product found in Pluchea indica with data available.
Molecule SMILES: CCC(C)CCC=CC(C)=CC(C)CCC=CC=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: Could you provide a description of this molecule <molecule_2d> ?

assistant: 17:4(2E,4E,9E,11E)(8Me[R],10Me,15Me[R]) is a long-chain fatty acid.
Molecule SMILES: CC1CN(C(=O)CN2CC(C)(C)OCC2C(=O)Nc2cc(Cl)cc3c2[nH]c2cnccc23)CC(C)O1

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: MLN0415 is a novel, small molecule IKK2 inhibitor, discovered by Millennium scientists. In preclinical studies, MLN0415 was shown to decrease NF-kB activation and down-regulate the expression of a number of inflammatory proteins. Because inflammatory proteins play a critical role in inflammation and drive the inflammatory response to disease, controlling these proteins may prevent or slow disease progression.
Molecule SMILES: CCCCCCC=CCc1[nH]c2ccccc2c(=O)c1C

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-[2-Nonenyl)-3-methyl-4-quinolinol is a natural product found in Burkholderia cepacia with data available.
Molecule SMILES: COc1cc(C2Oc3cc(C=O)cc(OC)c3OC2C)cc(OC)c1OC

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,3R)-5-methoxy-3-methyl-2-(3,4,5-trimethoxyphenyl)-2,3-dihydro-1,4-benzodioxine-7-carbaldehyde is a natural product found in Licaria chrysophylla with data available.
Molecule SMILES: Cn1nnc2ccc(C(c3ccc(Cl)cc3)n3cncn3)cc21

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: Vorozole is a member of benzotriazoles.
Molecule SMILES: CC([NH3+])C(=O)NC(CCC(N)=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: Given the molecule <molecule_2d>, what can you tell me about it?

assistant: Ala-Gln zwitterion is a peptide zwitterion obtained by transfer of a proton from the carboxy to the amino terminus of Ala-Gln. It is a tautomer of an Ala-Gln.
Molecule SMILES: CC([NH3+])C(=O)NC(CCC(N)=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: Tell me something about this molecule: <molecule_2d>

assistant: l-Alanyl-l-glutamine is a natural product found in Arabidopsis thaliana 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(OC(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: Provide a description of this molecule <molecule_2d> .

assistant: Staminol A is a natural product found in Orthosiphon aristatus with data available.
Molecule SMILES: O=S(=O)(Cl)C(Cl)(Cl)S(=O)(=O)CCl

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: Chloromethanesulfonyl-dichloromethanesulfonyl chloride is a sulfonic acid derivative.
Molecule SMILES: CC(=O)[O-].CCON=C(C(=O)NC1C(=O)N2C(C(=O)O)=C(Sc3nc(-c4cc[n+](C)cc4)cs3)CSC12)c1nsc(NP(=O)(O)O)n1.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: Ceftaroline Fosamil is an N-phosphono prodrug of the fifth-generation cephalosporin derivative ceftaroline with antibacterial activity. Ceftaroline fosamil is hydrolyzed to the active form ceftaroline in vivo. Ceftaroline binds to and inactivates penicillin-binding proteins (PBPs) located on the inner membrane of the bacterial cell wall. PBPs are enzymes involved in the terminal stages of assembling the bacterial cell wall and in reshaping the cell wall during growth and division. Inactivation of PBPs interferes with the cross-linkage of peptidoglycan chains necessary for bacterial cell wall strength and rigidity. This results in the weakening of the bacterial cell wall and causes cell lysis.
Molecule SMILES: CC(=O)[O-].CCON=C(C(=O)NC1C(=O)N2C(C(=O)O)=C(Sc3nc(-c4cc[n+](C)cc4)cs3)CSC12)c1nsc(NP(=O)(O)O)n1.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: Ceftaroline Fosamil Acetate is the acetic acid salt form of ceftaroline fosamil, an N-phosphono type prodrug of the fifth-generation cephalosporin derivative ceftaroline with antibacterial activity. Ceftaroline fosamil, when hydrolyzed to the active form ceftaroline, has a high affinity for penicillin binding protein 2a (PBP2a), which is associated with methicillin resistance. As a result, ceftaroline is unique in its activity against methicillin-resistant, vancomycin-intermediate, linezolid-resistant, and daptomycin-nonsusceptible strains.
Molecule SMILES: Oc1ccc(C=Cc2cc(O)c3c(c2)OC(c2ccc(O)cc2O)C3c2cc(O)cc(O)c2)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: 4-[3-(3,5-Dihydroxyphenyl)-4-hydroxy-6-[2-(4-hydroxyphenyl)ethenyl]-2,3-dihydro-1-benzofuran-2-yl]benzene-1,3-diol is a natural product found in Gnetum latifolium, Gnetum montanum, and Gnetum gnemon with data available.
Molecule SMILES: Cc1cccc(-n2cnc(C(=O)Nc3cccnc3)c2)n1

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: 1-(6-methyl-2-pyridinyl)-N-(3-pyridinyl)-4-imidazolecarboxamide is a heteroarene and an aromatic amide.
Molecule SMILES: COc1cc(-c2cc(=O)c3c(O)c(O)c(OC)cc3o2)cc(OC)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: 4',5,6-Trihydroxy-3',5',7-trimethoxyflavone is a natural product found in Lantana montevidensis with data available.
Molecule SMILES: CC(C)CCCC(C)C1CCC2(C)C(=O)C3(CCC12C)C(O)CC1C(C)C(O)CCC13C

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,2'S,3aR,3'aS,5R,6'S,7'S,7aR,7'aS)-2',6'-dihydroxy-3a,3'a,7',7a-tetramethyl-1-[(2R)-6-methylheptan-2-yl]spiro[2,3,6,7-tetrahydro-1H-indene-5,3'-2,4,5,6,7,7a-hexahydro-1H-indene]-4-one is a natural product found in Euphorbia officinarum with data available.
Molecule SMILES: CC1OC(CC(=O)O)Cc2cc3c(c(O)c21)C(=O)C1=C(C3=O)C2CC(OC3CCC(O)C(C)O3)C1(O)C(C)O2

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-[(1S,7S,9R,16R,18R,19R)-1,5-dihydroxy-19-[(2S,5S,6S)-5-hydroxy-6-methyloxan-2-yl]oxy-7,18-dimethyl-3,14-dioxo-8,17-dioxapentacyclo[14.2.2.02,15.04,13.06,11]icosa-2(15),4(13),5,11-tetraen-9-yl]acetic acid is a natural product found in Streptomyces with data available.
Molecule SMILES: CC1=C2CCC(C)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: Describe this molecule: <molecule_2d> .

assistant: P-Mentha-2,4(8)-dien-9,3-olide is a member of benzofurans.
Molecule SMILES: CCCCNC(=O)CSc1nc2ccc(N3CCOCC3)cc2c(=O)n1CCc1ccccc1

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-butyl-2-[[6-(4-morpholinyl)-4-oxo-3-(2-phenylethyl)-2-quinazolinyl]thio]acetamide is a member of quinazolines.
Molecule SMILES: CC1=CC(C)CC=CC2C=C(C)C(C)C3C(Cc4c[nH]c5ccccc45)NC(=O)C23C(=O)C=CC(=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 give me a brief overview of this molecule <molecule_2d> ?

assistant: Chaetoglobosin J is a cytochalasan alkaloid found in Chaetomium globosum. It has a role as an antineoplastic agent and a Chaetomium metabolite. It is a cytochalasan alkaloid, a member of indoles, a macrocycle and a secondary alpha-hydroxy ketone.
Molecule SMILES: CC1=CC(C)CC=CC2C=C(C)C(C)C3C(Cc4c[nH]c5ccccc45)NC(=O)C23C(=O)C=CC(=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 give me a brief overview of this molecule <molecule_2d> ?

assistant: Chaetoglobosin J is a natural product found in Chaetomium globosum and Chaetomium with data available.
Molecule SMILES: COc1c(O)c(C)c(CC=C(C)CCC=C(C)CCC=C(C)CCC=C(C)CCC=C(C)CCC=C(C)CCC=C(C)CCC=C(C)C)c(O)c1OC

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

user: Describe this molecule: <molecule_2d> .

assistant: Ubiquinol-8 is a ubiquinol in which the polyprenyl substituent is octaprenyl. It has a role as an antineoplastic agent. It is an ubiquinol and a polyprenylhydroquinone.
Molecule SMILES: COc1c(O)c(C)c(CC=C(C)CCC=C(C)CCC=C(C)CCC=C(C)CCC=C(C)CCC=C(C)CCC=C(C)CCC=C(C)C)c(O)c1OC

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

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

assistant: Ubiquinol-8 is a metabolite found in or produced by Escherichia coli (strain K12, MG1655).
Molecule SMILES: CC1(C)CCCC2(C)C1CCC13CC4C(CC12)C4(C=O)C3

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: (1R,4R,9R,10R,12S,13R,14R)-5,5,9-trimethylpentacyclo[11.2.1.01,10.04,9.012,14]hexadecane-13-carbaldehyde is a natural product found in Jungermannia exsertifolia with data available.
Molecule SMILES: COc1cc(C=CC(=O)OCC2OC(Oc3cc4c(OC5OC(COC(=O)CC(=O)O)C(O)C(O)C5O)cc(O)cc4[o+]c3-c3ccc(O)cc3)C(OC3OCC(O)C(O)C3O)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: 3-[[6-[3-[4,5-Dihydroxy-6-[3-(4-hydroxy-3-methoxyphenyl)prop-2-enoyloxymethyl]-3-(3,4,5-trihydroxyoxan-2-yl)oxyoxan-2-yl]oxy-7-hydroxy-2-(4-hydroxyphenyl)chromenylium-5-yl]oxy-3,4,5-trihydroxyoxan-2-yl]methoxy]-3-oxopropanoic acid is a natural product found in Matthiola incana with data available.
Molecule SMILES: CC(=O)OC1CC2C(C)(C)OC3CC(=O)OC32CC23CCC4(C)C(=O)C(C)C(C5C=C(C)C(=O)O5)C4C(O)(O2)C(=O)C13

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: [15-hydroxy-9,9,18,20-tetramethyl-17-(4-methyl-5-oxo-2H-furan-2-yl)-5,14,19-trioxo-4,8,23-trioxahexacyclo[13.7.1.01,13.03,7.03,10.016,20]tricosan-12-yl] acetate is a natural product found in Schisandra lancifolia with data available.
Molecule SMILES: CC(C)Oc1ccc(-c2nc(-c3cccc4c3CCC4NCCO)no2)cc1C#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 give me a brief overview of this molecule <molecule_2d> ?

assistant: Ozanimod is a once-daily sphingosine 1-phosphate receptor modulator for the treatment of relapsing Multiple Sclerosis (MS) and inflammatory bowel disease. It was developed by Celgene (now acquired by Bristol-Myers Squibb) and was approved by the FDA on March 26, 2020.  The US approval was followed by the approval in Canada on October 2, 2020. In November 2021, ozanimod was also approved by the European Commission for the treatment of adults with relapsing remitting multiple sclerosis.  MS is a devastating inflammatory disease that often progresses and causes severe neurological, physical, and cognitive effects. Inflammatory bowel disease also a chronic inflammatory condition and can cause persistent abdominal pain, diarrhea, bloody stools, and vomiting.  In clinical trials, Ozanimod has been shown to be well-tolerated and has resulted in a higher decrease in the rate of MS relapses than with intramuscular [interferon beta-1a], a current standard in MS therapy. Studies involving patients with inflammatory bowel disease have also shown promising results.
Molecule SMILES: CC(C)Oc1ccc(-c2nc(-c3cccc4c3CCC4NCCO)no2)cc1C#N

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: Ozanimod is an orally available immunomodulatory drug used to treat relapsing forms of multiple sclerosis. Ozanimod is associated with transient serum enzyme elevations during therapy but has not been linked to instances of clinically apparent liver injury with jaundice, although experience with its use has been limited.
Molecule SMILES: CC(C)Oc1ccc(-c2nc(-c3cccc4c3CCC4NCCO)no2)cc1C#N

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: Ozanimod is an orally bioavailable sphingosine-1-phosphate (S1P) receptors 1 (S1PR1, S1P1) and 5 (S1PR5, S1P5) modulator, with potential anti-inflammatory and immunomodulating activities. Upon oral administration, ozanimod selectively targets and binds to S1PR1 on lymphocytes and induces S1PR1 internalization and degradation. This results in the sequestration of lymphocytes in lymph nodes. By preventing egress of lymphocytes, ozanimod reduces both the amount of circulating peripheral lymphocytes and the infiltration of lymphocytes into target tissues. This prevents a lymphocyte-mediated immune response and may reduce inflammation. S1PR1, a G-protein coupled receptor, plays a key role in lymphocyte migration from lymphoid tissues. Modulation of S1PR5 by ozanimod may be neuroprotective.
Molecule SMILES: CC(C)Oc1ccc(-c2nc(-c3cccc4c3CCC4NCCO)no2)cc1C#N

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: Ozanimod is a Sphingosine 1-phosphate Receptor Modulator. The mechanism of action of ozanimod is as a Sphingosine 1-Phosphate Receptor Modulator.