CHEBI:134699 - opicapone

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name opicapone
ChEBI ID CHEBI:134699
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C15H10Cl2N4O6
Net Charge 0
Average Mass 413.170
Monoisotopic Mass 411.99774
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
InChIKey ASOADIZOVZTJSR-UHFFFAOYSA-N
SMILES C1=C(C(=C(C=C1C2=NC(=NO2)C=3C(=[N+](C(=C(C3C)Cl)C)[O-])Cl)O)O)[N+](=O)[O-]
ChEBI Ontology
Outgoing opicapone (CHEBI:134699) is a oxadiazole (CHEBI:46685)
opicapone (CHEBI:134699) is a ring assembly (CHEBI:36820)
Synonyms Sources
BIA 9-1067 DrugCentral
ongentys DrugCentral
Manual Xref Database
5143 DrugCentral
View more database links
Registry Number Type Source
923287-50-7 CAS Registry Number DrugCentral
Last Modified
23 February 2017