CHEBI:134418 - (12R)-hydroxy-10,11-dihydroleukotriene E4

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ChEBI Name (12R)-hydroxy-10,11-dihydroleukotriene E4
ChEBI ID CHEBI:134418
ChEBI ASCII Name (12R)-hydroxy-10,11-dihydroleukotriene E4
Definition A leukotriene with formula C23H39NO6S that results from the metabilism of leukotriene B4 by human keratinocytes.
Stars This entity has been manually annotated by the ChEBI Team.
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Formula C23H39NO6S
Net Charge 0
Average Mass 457.626
Monoisotopic Mass 457.24981
InChI InChI=1S/C23H39NO6S/c1-2-3-4-5-6-8-12-18(25)13-9-7-10-15-21(31-17-19(24)23(29)30)20(26)14-11-16-22(27)28/h6-10,15,18-21,25-26H,2-5,11-14,16-17,24H2,1H3,(H,27,28)(H,29,30)/b8-6-,9-7+,15-10+/t18-,19+,20+,21-/m1/s1
InChIKey FZJOTYMARNGISF-SHPAXQKOSA-N
SMILES C(/C=C\CCCCC)[C@H](C/C=C/C=C/[C@H]([C@@H](O)CCCC(=O)O)SC[C@H](N)C(=O)O)O
Metabolite of Species Details
Homo Sapiens (NCBI:txid9606) See: PubMed
Roles Classification
Chemical Role(s): Bronsted base
A molecular entity capable of accepting a hydron from a donor (Bronsted acid).
(via organic amino compound )
Bronsted acid
A molecular entity capable of donating a hydron to an acceptor (Bronsted base).
(via oxoacid )
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 (12R)-hydroxy-10,11-dihydroleukotriene E4 (CHEBI:134418) has role human xenobiotic metabolite (CHEBI:76967)
(12R)-hydroxy-10,11-dihydroleukotriene E4 (CHEBI:134418) is a L-cysteine thioether (CHEBI:27532)
(12R)-hydroxy-10,11-dihydroleukotriene E4 (CHEBI:134418) is a amino dicarboxylic acid (CHEBI:36164)
(12R)-hydroxy-10,11-dihydroleukotriene E4 (CHEBI:134418) is a diol (CHEBI:23824)
(12R)-hydroxy-10,11-dihydroleukotriene E4 (CHEBI:134418) is a leukotriene (CHEBI:25029)
(12R)-hydroxy-10,11-dihydroleukotriene E4 (CHEBI:134418) is a non-proteinogenic L-α-amino acid (CHEBI:83822)
(12R)-hydroxy-10,11-dihydroleukotriene E4 (CHEBI:134418) is a secondary alcohol (CHEBI:35681)
(12R)-hydroxy-10,11-dihydroleukotriene E4 (CHEBI:134418) is conjugate acid of (12R)-hydroxy-10,11-dihydroleukotriene E4(1−) (CHEBI:133320)
Incoming (12R)-hydroxy-10,11-dihydroleukotriene E4(1−) (CHEBI:133320) is conjugate base of (12R)-hydroxy-10,11-dihydroleukotriene E4 (CHEBI:134418)
IUPAC Name
(5S,6R,7E,9E,12R,14Z)-6-{[(2R)-2-amino-2-carboxyethyl]sulfanyl}-5,12-dihydroxyicosa-7,9,14-trienoic acid
Synonyms Sources
(5S,6R,12R)-Dihydroxy-6-(S-cysteinyl)-(7E,9E,14Z)-eicosatrienoic acid HMDB
5,12-Dihydroxy-6-cysteinyl-7,9,14-eicosatrienoic acid HMDB
5S,12R-Dihydroxy-6-S-cysteinyl-7E,9E,14Z-eicosatrienoic acid HMDB
ELTB3 HMDB
Manual Xref Database
HMDB0012501 HMDB
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Citation Waiting for Citations Type Source
8244977 PubMed citation Europe PMC
Last Modified
07 February 2017