CHEBI:139255 - 9-cis-4-oxoretinoic acid

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ChEBI Name 9-cis-4-oxoretinoic acid ChEBI ID CHEBI:139255 ChEBI ASCII Name 9-cis-4-oxoretinoic acid Definition A retinoid that consists of 9-cis-retinoic acid bearing an oxo substituent at position 4 on the cyclohexenyl ring. Stars This entity has been manually annotated by the ChEBI Team. Submitter Nevila Nouspikel 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 C20H26O3 Net Charge 0 Average Mass 314.419 Monoisotopic Mass 314.18819 InChI InChI=1S/C20H26O3/c1-14(7-6-8-15(2)13-19(22)23)9-10-17-16(3)18(21)11-12-20(17,4)5/h6-10,13H,11-12H2,1-5H3,(H,22,23)/b8-6+,10-9+,14-7-,15-13+ InChIKey GGCUJPCCTQNTJF-NAXRMXIQSA-N SMILES C1C(C(=C(C(C1)=O)C)\C=C\C(=C/C=C/C(=C/C(=O)O)/C)\C)(C)C Metabolite of Species Details Homo sapiens (NCBI:txid9606) Obtained from human plasma See: PubMed Roles Classification Biological Role(s): human xenobiotic metabolite Any human metabolite produced by metabolism of a xenobiotic compound in humans. View more via ChEBI Ontology ChEBI Ontology Outgoing 9-cis-4-oxoretinoic acid (CHEBI:139255) has functional parent 9-cis-retinoic acid (CHEBI:50648) 9-cis-4-oxoretinoic acid (CHEBI:139255) has role human xenobiotic metabolite (CHEBI:76967) 9-cis-4-oxoretinoic acid (CHEBI:139255) is a enone (CHEBI:51689) 9-cis-4-oxoretinoic acid (CHEBI:139255) is a retinoid (CHEBI:26537) 9-cis-4-oxoretinoic acid (CHEBI:139255) is conjugate acid of 9-cis-4-oxoretinoate (CHEBI:139254) Incoming 9-cis-4-oxoretinoate (CHEBI:139254) is conjugate base of 9-cis-4-oxoretinoic acid (CHEBI:139255) IUPAC Name (2E,4E,6Z,8E)-3,7-dimethyl-9-(2,6,6-trimethyl-3-oxocyclohex-1-en-1-yl)nona-2,4,6,8-tetraenoic acid Synonyms Sources (9cis)-4-oxoretinoic acid ChEBI 4-keto-9-cis-retinoic acid ChEBI 4-oxo-9-cis-retinoic acid SUBMITTER 9-cis-4-ketoretinoic acid ChEBI Registry Number Type Source 7518834 Reaxys Registry Number Reaxys Citations Types Sources 14532297 PubMed citation Europe PMC 8953164 PubMed citation Europe PMC 9243349 PubMed citation Europe PMC 9547704 PubMed citation Europe PMC Last Modified 06 February 2018