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CHEBI:140350 - (7S,14S)-dihydroxy-(4Z,8E,10E,12Z,16Z,19Z)-docosahexaenoate

ChEBI IDCHEBI:140350
ChEBI Name(7S,14S)-dihydroxy-(4Z,8E,10E,12Z,16Z,19Z)-docosahexaenoate
Stars
ASCII Name(7S,14S)-dihydroxy-(4Z,8E,10E,12Z,16Z,19Z)-docosahexaenoate
DefinitionA dihydroxydocosahexaenoate that is the conjugate base of (7S,14S)-dihydroxy-(4Z,8E,10E,12Z,16Z,19Z)-docosahexaenoic acid, obtained by deprotonation of the carboxy group; major species at pH 7.3.
Last Modified5 March 2018
SubmitterSteve
DownloadsMolfile
FormulaC22H31O4
Net Charge-1
Average Mass359.486
Monoisotopic Mass359.22278
SMILESCC/C=C\C/C=C\C[C@H](O)/C=C\C=C\C=C\[C@@H](O)C/C=C\CCC(=O)[O-]
InChIInChI=1S/C22H32O4/c1-2-3-4-5-6-10-15-20(23)16-11-7-8-12-17-21(24)18-13-9-14-19-22(25)26/h3-4,6-13,16-17,20-21,23-24H,2,5,14-15,18-19H2,1H3,(H,25,26)/p-1/b4-3-,8-7+,10-6-,13-9-,16-11-,17-12+/t20-,21+/m0/s1
InChIKeyHLHYXXBCQOUTGK-NVFVPEJPSA-M
ChEBI Ontology
Outgoing Relation(s)
(7S,14S)-dihydroxy-(4Z,8E,10E,12Z,16Z,19Z)-docosahexaenoate (CHEBI:140350) is a dihydroxydocosahexaenoate (CHEBI:136528)
(7S,14S)-dihydroxy-(4Z,8E,10E,12Z,16Z,19Z)-docosahexaenoate (CHEBI:140350) is conjugate base of (7S,14S)-dihydroxy-(4Z,8E,10E,12Z,16Z,19Z)-docosahexaenoic acid (CHEBI:140193)
Incoming Relation(s)
(7S,14S)-dihydroxy-(4Z,8E,10E,12Z,16Z,19Z)-docosahexaenoic acid (CHEBI:140193) is conjugate acid of (7S,14S)-dihydroxy-(4Z,8E,10E,12Z,16Z,19Z)-docosahexaenoate (CHEBI:140350)
IUPAC Name 
(4Z,7S,8E,10E,12Z,14S,16Z,19Z)-7,14-dihydroxydocosa-4,8,10,12,16,19-hexaenoate
Synonyms  Source
(4Z,7S,8E,10E,12Z,14S,16Z,19Z)-7,14-dihydroxydocosahexaenoateChEBI
7-epi-maresin 1(1−)ChEBI
(7S)-MaR1(1−)ChEBI
(7S,14S)-dihydroxydocosahexaenoateChEBI
(7S)-maresin 1(1−)ChEBI
7-epi-MaR1(1−)ChEBI