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CHEBI:6019 - Isohelenol

ChEBI IDCHEBI:6019
ChEBI NameIsohelenol
Stars
Last Modified28 July 2014
DownloadsMolfile
FormulaC15H18O5
Net Charge0
Average Mass278.304
Monoisotopic Mass278.11542
SMILES[H][C@@]12C[C@@H](C)[C@]3([H])C=CC(=O)[C@@]3(C)[C@@H](O)C1=C(CO)C(=O)O2
InChIInChI=1S/C15H18O5/c1-7-5-10-12(8(6-16)14(19)20-10)13(18)15(2)9(7)3-4-11(15)17/h3-4,7,9-10,13,16,18H,5-6H2,1-2H3/t7-,9+,10-,13+,15+/m1/s1
InChIKeyHNDYFBSTNFZJEB-JMLQNSIWSA-N
ChEBI Ontology
Outgoing Relation(s)
Isohelenol (CHEBI:6019) is a sesquiterpenoid (CHEBI:26658)
Synonym  Source
IsohelenolKEGG COMPOUND
Manual XrefsDatabases
C09485KEGG COMPOUND
C00003307KNApSAcK
Registry NumbersSources
CAS:71013-32-6KEGG COMPOUND