API0231551
Opicapone
Ondansetron is an antiemetic.
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CAS No.
923287-50-7
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Synonyms
Opicapone; 923287-50-7; ongentys
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CHEMBL ID
CHEMBL1089318
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Molecule Type
Small molecule
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Compound CID
135565903
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Molecular Weight (g/mol)
413.2
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Molecular Formula
C15H10Cl2N4O6
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InChI
InChI=1S/C15H10Cl2N4O6/c1-5-10(13(17)20(24)6(2)11(5)16)14-18-15(27-19-14)7-3-8(21(25)26)12(23)9(22)4-7/h3-4,22-23H,1-2H3
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InChIKey
ASOADIZOVZTJSR-UHFFFAOYSA-N
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SMILES
CC1=C(C(=[N+](C(=C1Cl)C)[O-])Cl)C2=NOC(=N2)C3=CC(=C(C(=C3)O)O)[N+](=O)[O-]
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IUPAC Name
5-[3-(2,5-dichloro-4,6-dimethyl-1-oxidopyridin-1-ium-3-yl)-1,2,4-oxadiazol-5-yl]-3-nitrobenzene-1,2-diol
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Exact Mass (Da)
411.9977394
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Monoisotopic Mass (Da)
411.9977394
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