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CHEBI:174938 - Aristolodione

ChEBI IDCHEBI:174938
ChEBI NameAristolodione
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC18H13NO4
Net Charge0
Average Mass307.305
Monoisotopic Mass307.08446
SMILESCOc1c(O)cc2c3c(cc4ccccc4c13)N(C)C(=O)C2=O
InChIInChI=1S/C18H13NO4/c1-19-12-7-9-5-3-4-6-10(9)15-14(12)11(16(21)18(19)22)8-13(20)17(15)23-2/h3-8,20H,1-2H3
InChIKeyJGDZUWXHWYXMSD-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)
Aristolodione (CHEBI:174938) has functional parent aporphine (CHEBI:35643)
Aristolodione (CHEBI:174938) is a isoquinoline alkaloid (CHEBI:24921)
IUPAC Name 
15-hydroxy-16-methoxy-10-methyl-10-azatetracyclo[7.7.1.02,7.013,17]heptadeca-1(17),2,4,6,8,13,15-heptaene-11,12-dione
Manual XrefsDatabases
160098ChemSpider
HMDB0033247HMDB
Registry NumbersSources
CAS:109771-09-7ChemIDplus