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CHEBI:6070 - Isovelleral

ChEBI IDCHEBI:6070
ChEBI NameIsovelleral
Stars
Last Modified28 July 2014
DownloadsMolfile
FormulaC15H20O2
Net Charge0
Average Mass232.323
Monoisotopic Mass232.14633
SMILES[H][C@]12CC(C)(C)C[C@@]1([H])C=C(C=O)[C@]1(C=O)C[C@]21C
InChIInChI=1S/C15H20O2/c1-13(2)5-10-4-11(7-16)15(9-17)8-14(15,3)12(10)6-13/h4,7,9-10,12H,5-6,8H2,1-3H3/t10-,12+,14-,15-/m1/s1
InChIKeyPJAAESPGJOSQGZ-DZGBDDFRSA-N
ChEBI Ontology
Outgoing Relation(s)
Isovelleral (CHEBI:6070) is a aldehyde (CHEBI:17478)
Synonym  Source
IsovelleralKEGG COMPOUND
Manual XrefsDatabases
C09692KEGG COMPOUND
C00003155KNApSAcK
Registry NumbersSources
CAS:37841-91-1KEGG COMPOUND