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CHEBI:9923 - Valeroidine

ChEBI IDCHEBI:9923
ChEBI NameValeroidine
Stars
Last Modified28 July 2014
DownloadsMolfile
FormulaC13H23NO3
Net Charge0
Average Mass241.331
Monoisotopic Mass241.16779
SMILESCC(C)CC(=O)O[C@@H]1CC2C[C@@H](O)C(C1)N2C
InChIInChI=1S/C13H23NO3/c1-8(2)4-13(16)17-10-5-9-6-12(15)11(7-10)14(9)3/h8-12,15H,4-7H2,1-3H3/t9?,10-,11?,12-/m1/s1
InChIKeyAPLLVFVOTXZBFO-RUJICJSRSA-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)
Valeroidine (CHEBI:9923) is a tropane alkaloid (CHEBI:37332)
Synonym  Source
ValeroidineKEGG COMPOUND
Manual XrefsDatabases
C10869KEGG COMPOUND
C00002307KNApSAcK
Registry NumbersSources
CAS:490-96-0KEGG COMPOUND