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CHEBI:15651 - leukotriene A4

ChEBI IDCHEBI:15651
ChEBI Nameleukotriene A4
Stars
ASCII Nameleukotriene A4
DefinitionA leukotriene that is the (5S,6S)-epoxy derivative of (7E,9E,11Z,14Z)-icosa-7,9,11,14-tetraenoic acid.
Secondary ChEBI IDsCHEBI:6420, CHEBI:10937, CHEBI:14503, CHEBI:25023
Last Modified10 June 2021
SubmitterMarcus Ennis
DownloadsMolfile
FormulaC20H30O3
Net Charge0
Average Mass318.457
Monoisotopic Mass318.21949
SMILESCCCCC/C=C\C/C=C\C=C\C=C\[C@@H]1O[C@H]1CCCC(=O)O
InChIInChI=1S/C20H30O3/c1-2-3-4-5-6-7-8-9-10-11-12-13-15-18-19(23-18)16-14-17-20(21)22/h6-7,9-13,15,18-19H,2-5,8,14,16-17H2,1H3,(H,21,22)/b7-6-,10-9-,12-11+,15-13+/t18-,19-/m0/s1
InChIKeyUFPQIRYSPUYQHK-WAQVJNLQSA-N
Wikipedia
Species of MetaboliteComponentSourceComments
Mus musculus (ncbitaxon:10090) - PubMed (19425150) Source: BioModels - MODEL1507180067
Phaseolus vulgaris (ncbitaxon:3885) - DOI (10.3390/ijms19041049)
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
Biological Roles:
human metabolite  Any mammalian metabolite produced during a metabolic reaction in humans (Homo sapiens).
plant metabolite  Any eukaryotic metabolite produced during a metabolic reaction in plants, the kingdom that include flowering plants, conifers and other gymnosperms.
mouse metabolite  Any mammalian metabolite produced during a metabolic reaction in a mouse (Mus musculus).
ChEBI Ontology
Outgoing Relation(s)
leukotriene A4 (CHEBI:15651) has functional parent icosa-7,9,11,14-tetraenoic acid (CHEBI:36038)
leukotriene A4 (CHEBI:15651) has role human metabolite (CHEBI:77746)
leukotriene A4 (CHEBI:15651) has role mouse metabolite (CHEBI:75771)
leukotriene A4 (CHEBI:15651) has role plant metabolite (CHEBI:76924)
leukotriene A4 (CHEBI:15651) is a epoxy fatty acid (CHEBI:61498)
leukotriene A4 (CHEBI:15651) is a leukotriene (CHEBI:25029)
leukotriene A4 (CHEBI:15651) is a long-chain fatty acid (CHEBI:15904)
leukotriene A4 (CHEBI:15651) is a oxylipin (CHEBI:61121)
leukotriene A4 (CHEBI:15651) is a polyunsaturated fatty acid (CHEBI:26208)
leukotriene A4 (CHEBI:15651) is conjugate acid of leukotriene A4(1−) (CHEBI:57463)
Incoming Relation(s)
4,5-leukotriene A4 (CHEBI:28367) has functional parent leukotriene A4 (CHEBI:15651)
leukotriene A4(1−) (CHEBI:57463) is conjugate base of leukotriene A4 (CHEBI:15651)
IUPAC Name 
(5S,6S,7E,9E,11Z,14Z)-5,6-epoxyicosa-7,9,11,14-tetraenoic acid
Synonyms  Source
Leukotriene A4KEGG COMPOUND
LTA4KEGG COMPOUND
(7E,9E,11Z,14Z)-(5S,6S)-5,6-epoxyeicosa-7,9,11,14-tetraenoic acidKEGG COMPOUND
5S,6S-epoxy-7E,9E,11Z,14Z-eicosatetraenoic acidLIPID MAPS
Oxiranebutanoic acid, 3-(1,3,5,8-tetradecatetraenyl)-, (2S-(2alpha,3beta(1E,3Z,5Z,8Z)))-ChemIDplus
5S,6S-leukotriene A4ChEBI
Manual XrefsDatabases
C00909KEGG COMPOUND
LMFA03020023LIPID MAPS
DJ3PDBeChem
HMDB0001337HMDB
C00053424KNApSAcK
Leukotriene_A4Wikipedia
Registry NumbersSources
Reaxys:5756170Reaxys
CAS:72059-45-1KEGG COMPOUND
CAS:72059-45-1ChemIDplus
Citations