CHEBI:80597 - 3-Hydroxycarbamazepine

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name 3-Hydroxycarbamazepine
ChEBI ID CHEBI:80597
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C15H12N2O2
Net Charge 0
Average Mass 252.26800
Monoisotopic Mass 252.08988
InChI InChI=1S/C15H12N2O2/c16-15(19)17-13-4-2-1-3-10(13)5-6-11-7-8-12(18)9-14(11)17/h1-9,18H,(H2,16,19)
InChIKey QQCFBZCATDIWTH-UHFFFAOYSA-N
SMILES NC(=O)N1c2ccccc2C=Cc2ccc(O)cc12
ChEBI Ontology
Outgoing 3-Hydroxycarbamazepine (CHEBI:80597) is a dibenzoazepine (CHEBI:47804)
3-Hydroxycarbamazepine (CHEBI:80597) is a ureas (CHEBI:47857)
Manual Xrefs Databases
C16602 KEGG COMPOUND
HMDB0060653 HMDB
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Registry Number Type Source
68011-67-6 CAS Registry Number KEGG COMPOUND
Last Modified
12 May 2016