CHEBI:90719 - 12,20-DiHETE(1−)

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name 12,20-DiHETE(1−)
ChEBI ID CHEBI:90719
ChEBI ASCII Name 12,20-DiHETE(1-)
Definition An icosanoid anion that is the conjugate base of 12,20-DiHETE 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 Nevila Nouspikel
Supplier Information
Download Molfile XML SDF
Formula C20H31O4
Net Charge -1
Average Mass 335.459
Monoisotopic Mass 335.22278
InChI InChI=1S/C20H32O4/c21-18-14-10-6-5-8-12-16-19(22)15-11-7-3-1-2-4-9-13-17-20(23)24/h2-4,7-8,11-12,15,19,21-22H,1,5-6,9-10,13-14,16-18H2,(H,23,24)/p-1/b4-2-,7-3-,12-8-,15-11+
InChIKey NUPDGIJXOAHJRW-LNESKJDXSA-M
SMILES C(=C\C(C/C=C\CCCCCO)O)/C=C\C/C=C\CCCC(=O)[O-]
ChEBI Ontology
Outgoing 12,20-DiHETE(1−) (CHEBI:90719) has functional parent 12-HETE(1−) (CHEBI:90718)
12,20-DiHETE(1−) (CHEBI:90719) is a ω-hydroxy-long-chain fatty acid anion (CHEBI:140992)
12,20-DiHETE(1−) (CHEBI:90719) is a dihydroxyicosatetraenoate (CHEBI:131877)
12,20-DiHETE(1−) (CHEBI:90719) is a icosanoid anion (CHEBI:62937)
12,20-DiHETE(1−) (CHEBI:90719) is a polyunsaturated fatty acid anion (CHEBI:76567)
12,20-DiHETE(1−) (CHEBI:90719) is conjugate base of 12,20-DiHETE (CHEBI:90990)
Incoming 12,20-DiHETE (CHEBI:90990) is conjugate acid of 12,20-DiHETE(1−) (CHEBI:90719)
IUPAC Name
(5Z,8Z,10E,14Z)-12,20-dihydroxyicosa-5,8,10,14-tetraenoate
Synonyms Sources
(5Z,8Z,10E,14Z)-12,20-dihydroxyicosatetraenoate ChEBI
12,20-dihydroxy-(5Z,8Z,10E,14Z)-eicosatetraenoate SUBMITTER
12,20-dihydroxy-(5Z,8Z,10E,14Z)-eicosatetraenoate UniProt
12,20-dihydroxy-(5Z,8Z,10E,14Z)-icosatetraenoate ChEBI
Citations Waiting for Citations Types Sources
15364545 PubMed citation SUBMITTER
9675028 PubMed citation SUBMITTER
Last Modified
23 January 2023