CHEBI:90823 - 13-HPODE(1−)

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ChEBI Name 13-HPODE(1−) ChEBI ID CHEBI:90823 ChEBI ASCII Name 13-HPODE(1-) Definition A hydroperoxy fatty acid anion that is the conjugate base of 13-HPODE arising from deprotonation of the carboxylic acid function; major species at pH 7.3. Stars This entity has been manually annotated by the ChEBI Team. Submitter AnneNiknejad 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 C18H31O4 Net Charge -1 Average Mass 311.437 Monoisotopic Mass 311.22278 InChI InChI=1S/C18H32O4/c1-2-3-11-14-17(22-21)15-12-9-7-5-4-6-8-10-13-16-18(19)20/h7,9,12,15,17,21H,2-6,8,10-11,13-14,16H2,1H3,(H,19,20)/p-1/b9-7-,15-12+ InChIKey JDSRHVWSAMTSSN-BSZOFBHHSA-M SMILES C(CCCCCCC/C=C\C=C\C(CCCCC)OO)(=O)[O-] Metabolite of Species Details Homo sapiens (NCBI:txid9606) 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 13-HPODE(1−) (CHEBI:90823) has role human xenobiotic metabolite (CHEBI:76967) 13-HPODE(1−) (CHEBI:90823) is a HPODE(1−) (CHEBI:131862) 13-HPODE(1−) (CHEBI:90823) is conjugate base of 13-HPODE (CHEBI:91272) Incoming 13(R)-HPODE(1−) (CHEBI:133985) is a 13-HPODE(1−) (CHEBI:90823) 13(S)-HPODE(1−) (CHEBI:57466) is a 13-HPODE(1−) (CHEBI:90823) 13-HPODE (CHEBI:91272) is conjugate acid of 13-HPODE(1−) (CHEBI:90823) IUPAC Name (9Z,11E)-13-hydroperoxyoctadeca-9,11-dienoate Synonym Source 13-hydroperoxy-(9Z,11E)-octadecadienoate UniProt Citation Type Source 10542053 PubMed citation SUBMITTER Last Modified 24 January 2023