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CHEBI:31120 - 3-O-Acetylhamayne

ChEBI IDCHEBI:31120
ChEBI Name3-O-Acetylhamayne
Stars
Last Modified28 July 2014
DownloadsMolfile
FormulaC18H19NO5
Net Charge0
Average Mass329.352
Monoisotopic Mass329.12632
SMILES[H][C@]12C[C@@H](OC(C)=O)C=C[C@]13c1cc4c(cc1C[N@@]2C[C@@H]3O)OCO4
InChIInChI=1S/C18H19NO5/c1-10(20)24-12-2-3-18-13-6-15-14(22-9-23-15)4-11(13)7-19(8-17(18)21)16(18)5-12/h2-4,6,12,16-17,21H,5,7-9H2,1H3/t12-,16-,17-,18-/m0/s1
InChIKeyNWAYYOQRSAEORM-JUKXBJQTSA-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)
3-O-Acetylhamayne (CHEBI:31120) is a alkaloid (CHEBI:22315)
Synonym  Source
3-O-AcetylhamayneKEGG COMPOUND
Manual XrefsDatabases
C00024355KNApSAcK
C12165KEGG COMPOUND