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CHEBI:3355 - Canellal

ChEBI IDCHEBI:3355
ChEBI NameCanellal
Stars
Last Modified28 July 2014
DownloadsMolfile
FormulaC15H20O3
Net Charge0
Average Mass248.322
Monoisotopic Mass248.14124
SMILES[H][C@@]12CC=C(C=O)[C@](O)(C=O)[C@@]1(C)CC[C@H](C)C2=C
InChIInChI=1S/C15H20O3/c1-10-6-7-14(3)13(11(10)2)5-4-12(8-16)15(14,18)9-17/h4,8-10,13,18H,2,5-7H2,1,3H3/t10-,13-,14-,15+/m0/s1
InChIKeyLDAIOVKPAKFZHM-FBUXBERBSA-N
ChEBI Ontology
Outgoing Relation(s)
Canellal (CHEBI:3355) is a sesquiterpenoid (CHEBI:26658)
Synonyms  Source
CanellalKEGG COMPOUND
MuzigadialKEGG COMPOUND
Manual XrefsDatabases
C09626KEGG COMPOUND
C00003107KNApSAcK
Registry NumbersSources
CAS:66550-09-2KEGG COMPOUND