CHEBI:88921 - 1-(2,6,6-Trimethyl-1-cyclohexen-1-yl)-1-penten-3-one

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ChEBI Name 1-(2,6,6-Trimethyl-1-cyclohexen-1-yl)-1-penten-3-one ChEBI ID CHEBI:88921 Stars This entity has been manually annotated by a third party. Supplier Information Download Molfile XML SDF Find compounds which contain this structure Find compounds which resemble this structure Take structure to the Advanced Search Formula C14H22O Net Charge 0 Average Mass 206.324 Monoisotopic Mass 206.16707 InChI InChI=1S/C14H22O/c1-5-12(15)8-9-13-11(2)7-6-10-14(13,3)4/h8-9H,5-7,10H2,1-4H3/b9-8+ InChIKey LMWNGLDCJDIIBR-CMDGGOBGSA-N SMILES CCC(/C=C/C1=C(C)CCCC1(C)C)=O Metabolite of Species Details Homo sapiens (NCBI:txid9606) Found in urine (BTO:0001419). See: PubMed ChEBI Ontology Outgoing 1-(2,6,6-Trimethyl-1-cyclohexen-1-yl)-1-penten-3-one (CHEBI:88921) is a monoterpene (CHEBI:35187) Synonyms Sources (1E)-1-(2,6,6-Trimethyl-1-cyclohexen-1-yl)-1-penten-3-one HMDB (1E)-1-(2,6,6-trimethylcyclohex-1-en-1-yl)pent-1-en-3-one HMDB 1-(2,6,6-Trimethyl-1-cyclohexen-1-yl)-1-Penten-3-one HMDB 1-Methyl-b-ionone HMDB 1-penten-3-one-(2,6,6-trimethyl-1-cyclohen-1-yl) HMDB 5-(2,6, 6-Trimethyl-1-cyclohexenyl)-4-penten-3-one HMDB 5-(2,6,6-Trimethyl-1-cyclohexenyl)-4-penten-3-one HMDB b-Methylionone HMDB beta Methyl ionone HMDB beta-Iraldeine HMDB beta-Methylionone HMDB beta-N-Methyl ionone HMDB FEMA 2712 HMDB Methyl ionone HMDB Methyl-beta-ionone HMDB Manual Xref Database HMDB0038130 HMDB View more database links Registry Number Type Source 127-43-5 CAS Registry Number KEGG COMPOUND Citation Type Source 24023812 PubMed citation Europe PMC