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CHEBI:214872 - (4R,5R,6S)-5,14-dihydro-4-hydroxy-gamma-ionylideneacetic acid

ChEBI IDCHEBI:214872
ChEBI Name(4R,5R,6S)-5,14-dihydro-4-hydroxy-gamma-ionylideneacetic acid
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC15H24O3
Net Charge0
Average Mass252.354
Monoisotopic Mass252.17254
SMILESCC(/C=C/[C@H]1[C@@H](C)[C@H](O)CCC1(C)C)=C\C(=O)O
InChIInChI=1S/C15H24O3/c1-10(9-14(17)18)5-6-12-11(2)13(16)7-8-15(12,3)4/h5-6,9,11-13,16H,7-8H2,1-4H3,(H,17,18)/b6-5+,10-9+/t11-,12+,13-/m1/s1
InChIKeyAGVNWFYCDMKHJC-YGQWZHAVSA-N
Species of MetaboliteComponentSourceComments
Sanghuangporusspecies (ncbitaxon:2267874) - DOI (10.1016/j.phytol.2020.03.007)
ChEBI Ontology
Outgoing Relation(s)
(4R,5R,6S)-5,14-dihydro-4-hydroxy-gamma-ionylideneacetic acid (CHEBI:214872) is a sesquiterpenoid (CHEBI:26658)
IUPAC Name 
(2E,4E)-5-[(1S,5R,6R)-5-hydroxy-2,2,6-trimethylcyclohexyl]-3-methylpenta-2,4-dienoic acid