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CHEBI:5687 - Heterodendrin

ChEBI IDCHEBI:5687
ChEBI NameHeterodendrin
Stars
Last Modified28 July 2014
DownloadsMolfile
FormulaC11H19NO6
Net Charge0
Average Mass261.274
Monoisotopic Mass261.12124
SMILESCC(C)[C@@H](C#N)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O
InChIInChI=1S/C11H19NO6/c1-5(2)6(3-12)17-11-10(16)9(15)8(14)7(4-13)18-11/h5-11,13-16H,4H2,1-2H3/t6-,7-,8-,9+,10-,11-/m1/s1
InChIKeyCQWWASNOGSDPRL-MPVQUNCYSA-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)
Heterodendrin (CHEBI:5687) is a cyanogenic glycoside (CHEBI:23436)
Synonym  Source
HeterodendrinKEGG COMPOUND
Manual XrefsDatabases
C08332KEGG COMPOUND
C00001445KNApSAcK
Registry NumbersSources
CAS:66465-22-3KEGG COMPOUND