CHEBI:132083 - 18(S)-HEPE(1−)

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ChEBI Name 18(S)-HEPE(1−) ChEBI ID CHEBI:132083 ChEBI ASCII Name 18(S)-HEPE(1-) Definition An 18-HEPE(1−) that is the conjugate base of 18(S)-HEPE, arising from deprotonation of the carboxylic acid group; major species at pH 7.3. 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 C20H29O3 Net Charge -1 Average Mass 317.443 Monoisotopic Mass 317.21222 InChI InChI=1S/C20H30O3/c1-2-19(21)17-15-13-11-9-7-5-3-4-6-8-10-12-14-16-18-20(22)23/h4-7,10-13,15,17,19,21H,2-3,8-9,14,16,18H2,1H3,(H,22,23)/p-1/b6-4-,7-5-,12-10-,13-11-,17-15+/t19-/m0/s1 InChIKey LRWYBGFSVUBWMO-OKIFYYRFSA-M SMILES C(\CCCC([O-])=O)=C\C/C=C\C/C=C\C/C=C\C=C\[C@H](CC)O Roles Classification Biological Role(s): human xenobiotic metabolite Any human metabolite produced by metabolism of a xenobiotic compound in humans. (via 18-HEPE(1-) ) View more via ChEBI Ontology ChEBI Ontology Outgoing 18(S)-HEPE(1−) (CHEBI:132083) is a 18-HEPE(1−) (CHEBI:90825) 18(S)-HEPE(1−) (CHEBI:132083) is conjugate base of 18(S)-HEPE (CHEBI:132801) 18(S)-HEPE(1−) (CHEBI:132083) is enantiomer of 18(R)-HEPE(1−) (CHEBI:90818) Incoming 18(S)-HEPE (CHEBI:132801) is conjugate acid of 18(S)-HEPE(1−) (CHEBI:132083) 18(R)-HEPE(1−) (CHEBI:90818) is enantiomer of 18(S)-HEPE(1−) (CHEBI:132083) IUPAC Name (5Z,8Z,11Z,14Z,16E,18S)-18-hydroxyicosa-5,8,11,14,16-pentaenoate Synonyms Sources (18S)-hydroxy-(5Z,8Z,11Z,14Z,16E)-eicosapentaenoate UniProt (18S)-hydroxy-(5Z,8Z,11Z,14Z,16E)-icosapentaenoate ChEBI Citation Type Source 21206090 PubMed citation SUBMITTER Last Modified 22 July 2016