CHEBI:90813 - 5(S),15(S)-DiHETE(1−)

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ChEBI Name 5(S),15(S)-DiHETE(1−)
ChEBI ID CHEBI:90813
ChEBI ASCII Name 5(S),15(S)-DiHETE(1-)
Definition An icosanoid anion that is the conjugate base of 5(S),15(S)-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 AnneNiknejad
Supplier Information
Download Molfile XML SDF
Formula C20H31O4
Net Charge -1
Average Mass 335.459
Monoisotopic Mass 335.22278
InChI InChI=1S/C20H32O4/c1-2-3-9-13-18(21)14-10-7-5-4-6-8-11-15-19(22)16-12-17-20(23)24/h5-8,10-11,14-15,18-19,21-22H,2-4,9,12-13,16-17H2,1H3,(H,23,24)/p-1/b7-5-,8-6-,14-10+,15-11+/t18-,19+/m0/s1
InChIKey UXGXCGPWGSUMNI-BVHTXILBSA-M
SMILES C(CCC[C@@H](/C=C/C=C\C\C=C/C=C/[C@H](CCCCC)O)O)([O-])=O
Metabolite of Species Details
Rattus norvegicus (NCBI:txid10116) See: PubMed
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.
rat metabolite
Any mammalian metabolite produced during a metabolic reaction in rat (Rattus norvegicus).
View more via ChEBI Ontology
ChEBI Ontology
Outgoing 5(S),15(S)-DiHETE(1−) (CHEBI:90813) has role human xenobiotic metabolite (CHEBI:76967)
5(S),15(S)-DiHETE(1−) (CHEBI:90813) has role rat metabolite (CHEBI:86264)
5(S),15(S)-DiHETE(1−) (CHEBI:90813) is a dihydroxyicosatetraenoate (CHEBI:131877)
5(S),15(S)-DiHETE(1−) (CHEBI:90813) is a hydroxy fatty acid anion (CHEBI:59835)
5(S),15(S)-DiHETE(1−) (CHEBI:90813) is a icosanoid anion (CHEBI:62937)
5(S),15(S)-DiHETE(1−) (CHEBI:90813) is a long-chain fatty acid anion (CHEBI:57560)
5(S),15(S)-DiHETE(1−) (CHEBI:90813) is a polyunsaturated fatty acid anion (CHEBI:76567)
5(S),15(S)-DiHETE(1−) (CHEBI:90813) is conjugate base of 5(S),15(S)-DiHETE (CHEBI:91286)
Incoming 5(S),15(S)-DiHETE (CHEBI:91286) is conjugate acid of 5(S),15(S)-DiHETE(1−) (CHEBI:90813)
IUPAC Name
(5S,6E,8Z,11Z,13E,15S)-5,15-dihydroxyicosa-6,8,11,13-tetraenoate
Synonyms Sources
(5S,15S)-dihydroxy-(6E,8Z,11Z,13E)-eicosatetraenoate UniProt
(5S,15S)-dihydroxy-(6E,8Z,11Z,13E)-eicosatetraenoate ChEBI
(5S,15S)-dihydroxy-(6E,8Z,11Z,13E)-icosatetraenoate ChEBI
(5S,6E,8Z,11Z,13E,15S)-5,15-dihydroxyicosatetraenoate ChEBI
Last Modified
03 October 2016