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CHEBI:31437 - Crinine

ChEBI IDCHEBI:31437
ChEBI NameCrinine
Stars
Last Modified28 July 2014
DownloadsMolfile
FormulaC16H17NO3
Net Charge0
Average Mass271.316
Monoisotopic Mass271.12084
SMILES[H][C@@]12C[C@@H](O)C=C[C@]13CC[N@@]2Cc1cc2c(cc13)OCO2
InChIInChI=1S/C16H17NO3/c18-11-1-2-16-3-4-17(15(16)6-11)8-10-5-13-14(7-12(10)16)20-9-19-13/h1-2,5,7,11,15,18H,3-4,6,8-9H2/t11-,15+,16+/m0/s1
InChIKeyRPAORVSEYNOMBR-IUIKQTSFSA-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)
Crinine (CHEBI:31437) is a alkaloid (CHEBI:22315)
Synonym  Source
CrinineKEGG COMPOUND
Manual XrefsDatabases
C00024384KNApSAcK
C12162KEGG COMPOUND