Terminology Service for NFDI4Health
vomifoliol
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http://purl.obolibrary.org/obo/CHEBI_28258
A fenchane monoterpenoid that is 3,5,5-trimethylcyclohex-2-en-1-one substituted by a hydroxy and a (1E)-3-hydroxybut-1-en-1-yl group at position 4.
Term info
Label
vomifoliol
Synonyms
- 4-hydroxy-4-[(1E)-3-hydroxybut-1-en-1-yl]-3,5,5-trimethylcyclohex-2-en-1-one
- Vomifoliol
Subsets
3_STAR
charge
0
formula
C13H20O3
has alternative id
CHEBI:18464, CHEBI:11087, CHEBI:69
has obo namespace
chebi_ontology
has related synonym
(+/-)-6-Hydroxy-3-oxo-alpha-ionol, (+/-)-6-hydroxy-3-oxo-alpha-ionol
id
CHEBI:28258
inchi
InChI=1S/C13H20O3/c1-9-7-11(15)8-12(3,4)13(9,16)6-5-10(2)14/h5-7,10,14,16H,8H2,1-4H3/b6-5+
inchikey
KPQMCAKZRXOZLB-AATRIKPKSA-N
mass
224.29610
monoisotopicmass
224.14124
smiles
CC(O)\C=C\C1(O)C(C)=CC(=O)CC1(C)C