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CHEBI:3914 - Crinamine

ChEBI IDCHEBI:3914
ChEBI NameCrinamine
Stars
Last Modified28 July 2014
DownloadsMolfile
FormulaC17H19NO4
Net Charge0
Average Mass301.342
Monoisotopic Mass301.13141
SMILES[H][C@]12C[C@@H](OC)C=C[C@]13c1cc4c(cc1C[N@@]2C[C@@H]3O)OCO4
InChIInChI=1S/C17H19NO4/c1-20-11-2-3-17-12-6-14-13(21-9-22-14)4-10(12)7-18(8-16(17)19)15(17)5-11/h2-4,6,11,15-16,19H,5,7-9H2,1H3/t11-,15-,16-,17-/m0/s1
InChIKeyYGPRSGKVLATIHT-SPOWBLRKSA-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)
Crinamine (CHEBI:3914) is a alkaloid (CHEBI:22315)
Synonyms  Source
(3alpha,5alpha,11R,13beta,19alpha)-1, 2-Didehydro-3-methoxycrinan-11-olKEGG COMPOUND
CrinamineKEGG COMPOUND
Manual XrefsDatabases
C00001569KNApSAcK
C08525KEGG COMPOUND
Registry NumbersSources
CAS:639-41-8KEGG COMPOUND