3-Hydroxy-beta-ionone (CHEBI:177961)

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This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.

ChEBI Name	3-Hydroxy-beta-ionone

ChEBI ID	CHEBI:177961

Stars	This entity has been manually annotated by a third party.

Submitter	MetaboLights

Supplier Information

Download	Molfile XML SDF

Formula

C13H20O2

Net Charge

Average Mass

208.301

Monoisotopic Mass

208.14633

InChI

InChI=1S/C13H20O2/c1-9-7-11(15)8-13(3,4)12(9)6-5-10(2)14/h5-6,11,15H,7-8H2,1-4H3/b6-5+

InChIKey

HFRZSVYKDDZRQY-AATRIKPKSA-N

SMILES

OC1CC(C(=C(C1)C)/C=C/C(=O)C)(C)C

Metabolite of Species	Details
Bombyx mori (NCBI:txid7091)	Found in hemolymph (BTO:0000572). See: MetaboLights Study

ChEBI Ontology
Outgoing	3-Hydroxy-beta-ionone (CHEBI:177961) is a sesquiterpenoid (CHEBI:26658)

IUPAC Name

(E)-4-(4-hydroxy-2,6,6-trimethylcyclohexen-1-yl)but-3-en-2-one