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CHEBI:53026 - (5S,6S)-dihydroxy-(7E,9E,11Z,14Z)-icosatetraenoic acid

ChEBI IDCHEBI:53026
ChEBI Name(5S,6S)-dihydroxy-(7E,9E,11Z,14Z)-icosatetraenoic acid
Stars
ASCII Name(5S,6S)-dihydroxy-(7E,9E,11Z,14Z)-icosatetraenoic acid
DefinitionA leukotriene compound having double bonds in the 7-, 9-, 11- and 14-positions and 5(S)- and 6(S)-hydroxy substituents.
Last Modified29 August 2017
Submitterkieran
DownloadsMolfile
FormulaC20H32O4
Net Charge0
Average Mass336.472
Monoisotopic Mass336.23006
SMILESCCCCC/C=C\C/C=C\C=C\C=C\[C@H](O)[C@@H](O)CCCC(=O)O
InChIInChI=1S/C20H32O4/c1-2-3-4-5-6-7-8-9-10-11-12-13-15-18(21)19(22)16-14-17-20(23)24/h6-7,9-13,15,18-19,21-22H,2-5,8,14,16-17H2,1H3,(H,23,24)/b7-6-,10-9-,12-11+,15-13+/t18-,19-/m0/s1
InChIKeyUVZBUUTTYHTDRR-WAQVJNLQSA-N
Species of MetaboliteComponentSourceComments
Saccharomyces cerevisiae (ncbitaxon:4932) - PubMed (24678285) Source: yeast.sf.net
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
Biological Role:
Saccharomyces cerevisiae metabolite  Any fungal metabolite produced during a metabolic reaction in Baker's yeast (Saccharomyces cerevisiae ).
ChEBI Ontology
Outgoing Relation(s)
(5S,6S)-dihydroxy-(7E,9E,11Z,14Z)-icosatetraenoic acid (CHEBI:53026) has functional parent icosa-7,9,11,14-tetraenoic acid (CHEBI:36038)
(5S,6S)-dihydroxy-(7E,9E,11Z,14Z)-icosatetraenoic acid (CHEBI:53026) has role Saccharomyces cerevisiae metabolite (CHEBI:75772)
(5S,6S)-dihydroxy-(7E,9E,11Z,14Z)-icosatetraenoic acid (CHEBI:53026) is a dihydroxyicosatetraenoic acid (CHEBI:72868)
(5S,6S)-dihydroxy-(7E,9E,11Z,14Z)-icosatetraenoic acid (CHEBI:53026) is a leukotriene (CHEBI:25029)
IUPAC Name 
(5S,6S,7E,9E,11Z,14Z)-5,6-dihydroxyicosa-7,9,11,14-tetraenoic acid
Synonyms  Source
5S,6S-dihydroxy-7E,9E,11Z,14Z-eicosatetraenoic acidLIPID MAPS
5S,6S-DiHETELIPID MAPS
(5S,6S,7E,9E,11Z,14Z)-5,6-dihydroxyeicosa-7,9,11,14-tetraenoic acidChEBI
threo-(5S,6S)-dihydroxy-7,9-trans-11,14-cis-eicosatetraenoic acidChEBI
(5S,6S,7E,9E,11Z,14Z)-5,6-dihydroxyicosatetraenoic acidChEBI
(5S,6S)-di-HETEChEBI
Manual XrefsDatabases
LMFA03060018LIPID MAPS
Registry NumbersSources
Reaxys:5282507Reaxys