CHEBI:57448 - (5Z,9E,12S,14Z)-8,11,12-trihydroxyicosa-5,9,14-trienoate

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ChEBI Name (5Z,9E,12S,14Z)-8,11,12-trihydroxyicosa-5,9,14-trienoate
ChEBI ID CHEBI:57448
ChEBI ASCII Name (5Z,9E,12S,14Z)-8,11,12-trihydroxyicosa-5,9,14-trienoate
Definition Conjugate base of (5Z,9E,12S,14Z)-8,11,12-trihydroxyicosa-5,9,14-trienoic acid arising from deprotonation of the carboxylic acid function.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
Download Molfile XML SDF
Formula C20H33O5
Net Charge -1
Average Mass 353.47300
Monoisotopic Mass 353.23280
InChI InChI=1S/C20H34O5/c1-2-3-4-5-6-10-13-18(22)19(23)16-15-17(21)12-9-7-8-11-14-20(24)25/h6-7,9-10,15-19,21-23H,2-5,8,11-14H2,1H3,(H,24,25)/p-1/b9-7-,10-6-,16-15+/t17?,18-,19?/m1/s1
InChIKey WPLPEZUSILBTGP-LTNYKQEOSA-M
SMILES CCCCC\C=C/C[C@@H](O)C(O)\C=C\C(O)C\C=C/CCCC([O-])=O
Metabolite of Species Details
Homo sapiens (NCBI:txid9606) See: DOI
Roles Classification
Biological Role(s): human metabolite
Any mammalian metabolite produced during a metabolic reaction in humans (Homo sapiens).
View more via ChEBI Ontology
ChEBI Ontology
Outgoing (5Z,9E,12S,14Z)-8,11,12-trihydroxyicosa-5,9,14-trienoate (CHEBI:57448) has role human metabolite (CHEBI:77746)
(5Z,9E,12S,14Z)-8,11,12-trihydroxyicosa-5,9,14-trienoate (CHEBI:57448) is a ethanediol derivative (CHEBI:140594)
(5Z,9E,12S,14Z)-8,11,12-trihydroxyicosa-5,9,14-trienoate (CHEBI:57448) is a hydroxy monocarboxylic acid anion (CHEBI:36059)
(5Z,9E,12S,14Z)-8,11,12-trihydroxyicosa-5,9,14-trienoate (CHEBI:57448) is conjugate base of (5Z,9E,12S,14Z)-8,11,12-trihydroxyicosa-5,9,14-trienoic acid (CHEBI:15630)
Incoming (5Z,9E,12S,14Z)-8,11,12-trihydroxyicosa-5,9,14-trienoic acid (CHEBI:15630) is conjugate acid of (5Z,9E,12S,14Z)-8,11,12-trihydroxyicosa-5,9,14-trienoate (CHEBI:57448)
IUPAC Name
(5Z,9E,12S,14Z)-8,11,12-trihydroxyicosa-5,9,14-trienoate
Synonym Source
(5Z,9E,14Z)-(8ξ,11ξ,12S)-8,11,12-trihydroxyicosa-5,9,14-trienoate UniProt
Last Modified
15 February 2024