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CHEBI:32118 - Sanguirubine

ChEBI IDCHEBI:32118
ChEBI NameSanguirubine
Stars
Last Modified28 July 2014
DownloadsMolfile
FormulaC22H20NO5
Net Charge+1
Average Mass378.404
Monoisotopic Mass378.13360
SMILESCOc1cc2ccc3c4c(OC)cc5c(c4c[n+](C)c3c2cc1OC)OCO5
InChIInChI=1S/C22H20NO5/c1-23-10-15-20(18(26-4)9-19-22(15)28-11-27-19)13-6-5-12-7-16(24-2)17(25-3)8-14(12)21(13)23/h5-10H,11H2,1-4H3/q+1
InChIKeyFUAPOWMHFINSMM-UHFFFAOYSA-N
Roles Classification
Biological Role:
metabolite  Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
ChEBI Ontology
Outgoing Relation(s)
Sanguirubine (CHEBI:32118) is a benzophenanthridine alkaloid (CHEBI:38517)
Synonym  Source
SanguirubineKEGG COMPOUND
Manual XrefsDatabases
C12230KEGG COMPOUND