EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:31154 - 9-O-Demethylhomolycorine

ChEBI IDCHEBI:31154
ChEBI Name9-O-Demethylhomolycorine
Stars
Last Modified28 July 2014
DownloadsMolfile
FormulaC17H19NO4
Net Charge0
Average Mass301.342
Monoisotopic Mass301.13141
SMILES[H][C@@]12c3cc(OC)c(O)cc3C(=O)O[C@]1([H])CC=C1CCN(C)[C@]12[H]
InChIInChI=1S/C17H19NO4/c1-18-6-5-9-3-4-13-15(16(9)18)10-8-14(21-2)12(19)7-11(10)17(20)22-13/h3,7-8,13,15-16,19H,4-6H2,1-2H3/t13-,15-,16-/m1/s1
InChIKeyVLDOBKJPRUQEEC-FVQBIDKESA-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)
9-O-Demethylhomolycorine (CHEBI:31154) is a alkaloid (CHEBI:22315)
Synonym  Source
9-O-DemethylhomolycorineKEGG COMPOUND
Manual XrefsDatabases
C00024361KNApSAcK
C00024387KNApSAcK
C12190KEGG COMPOUND
Registry NumbersSources
CAS:6879-81-8KEGG COMPOUND