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CHEBI:182573 - 11-Methoxyduguesuramine

ChEBI IDCHEBI:182573
ChEBI Name11-Methoxyduguesuramine
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC21H19NO5
Net Charge0
Average Mass365.385
Monoisotopic Mass365.12632
SMILESCOc1cc2c(=O)cc3c4c(cc5c(c4c2cc1OC)OCO5)CCN3C
InChIInChI=1S/C21H19NO5/c1-22-5-4-11-6-18-21(27-10-26-18)20-13-8-17(25-3)16(24-2)7-12(13)15(23)9-14(22)19(11)20/h6-9H,4-5,10H2,1-3H3
InChIKeyJBCBRQWZEJZJJP-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)
11-Methoxyduguesuramine (CHEBI:182573) is a alkaloid (CHEBI:22315)
IUPAC Name 
17,18-dimethoxy-11-methyl-3,5-dioxa-11-azapentacyclo[10.8.1.02,6.08,21.015,20]henicosa-1(21),2(6),7,12,15,17,19-heptaen-14-one