CHEBI:172146 - Methyl-delta-ionone

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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 Methyl-delta-ionone
ChEBI ID CHEBI:172146
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C14H22O
Net Charge 0
Average Mass 206.329
Monoisotopic Mass 206.16707
InChI InChI=1S/C14H22O/c1-5-12(15)8-9-13-11(2)7-6-10-14(13,3)4/h6-9,11,13H,5,10H2,1-4H3/b9-8+
InChIKey ZQJCPDKTEXSWTH-CMDGGOBGSA-N
SMILES O=C(\C=C\C1C(CC=CC1C)(C)C)CC
Metabolite of Species Details
Homo sapiens (NCBI:txid9606) Found in blood plasma (BTO:0000131). of strain [] See: MetaboLights Study
Homo sapiens (NCBI:txid9606) Found in Pooled sample (NCIT:C45910). of strain [] See: MetaboLights Study
ChEBI Ontology
Outgoing Methyl-delta-ionone (CHEBI:172146) is a sesquiterpenoid (CHEBI:26658)
IUPAC Name
(E)-1-(2,6,6-trimethylcyclohex-3-en-1-yl)pent-1-en-3-one
Manual Xrefs Databases
4576434 ChemSpider
HMDB0032397 HMDB
View more database links
Registry Number Type Source
7784-98-7 CAS Registry Number ChemIDplus