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CHEBI:140406 - 16,17(S)-dihydroxy-(7Z,10Z,13E,14E,19Z)-docosapentaenoate

Default Structure
ChEBI IDCHEBI:140406
ChEBI Name16,17(S)-dihydroxy-(7Z,10Z,13E,14E,19Z)-docosapentaenoate
Stars
ASCII Name16,17(S)-dihydroxy-(7Z,10Z,13E,14E,19Z)-docosapentaenoate
DefinitionA docosanoid anion that is the conjugate base of 16,17(S)-dihydroxy-(7Z,10Z,13E,14E,19Z)-docosapentaenoic acid, obtained by deprotonation of the carboxy group; major species at pH 7.3.
Last Modified12 March 2018
SubmitterSteve
DownloadsMolfile
FormulaC22H33O4
Net Charge-1
Average Mass361.502
Monoisotopic Mass361.23843
SMILESCC/C=C\C[C@H](O)C(O)/C=C/C=C/C=C\C/C=C\CCCCCC(=O)[O-]
InChIInChI=1S/C22H34O4/c1-2-3-14-17-20(23)21(24)18-15-12-10-8-6-4-5-7-9-11-13-16-19-22(25)26/h3,5-8,10,12,14-15,18,20-21,23-24H,2,4,9,11,13,16-17,19H2,1H3,(H,25,26)/p-1/b7-5-,8-6-,12-10+,14-3-,18-15+/t20-,21?/m0/s1
InChIKeyHRNHRTOXACGZNE-KXMOHCNRSA-M
ChEBI Ontology
Outgoing Relation(s)
16,17(S)-dihydroxy-(7Z,10Z,13E,14E,19Z)-docosapentaenoate (CHEBI:140406) is a docosanoid anion (CHEBI:131864)
16,17(S)-dihydroxy-(7Z,10Z,13E,14E,19Z)-docosapentaenoate (CHEBI:140406) is a hydroxy polyunsaturated fatty acid anion (CHEBI:131871)
16,17(S)-dihydroxy-(7Z,10Z,13E,14E,19Z)-docosapentaenoate (CHEBI:140406) is conjugate base of 16,17(S)-dihydroxy-(7Z,10Z,13E,14E,19Z)-docosapentaenoic acid (CHEBI:140266)
Incoming Relation(s)
16,17(S)-dihydroxy-(7Z,10Z,13E,14E,19Z)-docosapentaenoic acid (CHEBI:140266) is conjugate acid of 16,17(S)-dihydroxy-(7Z,10Z,13E,14E,19Z)-docosapentaenoate (CHEBI:140406)
IUPAC Name 
(7Z,10Z,12E,14E,17S,19Z)-16,17-dihydroxydocosa-7,10,12,14,19-pentaenoate
Synonyms  Source
16,17(S)-dihydroxy-7Z,10Z,13E,14E,19Z-docosapentaenoateChEBI
16,17(S)-dihydroxy-omega3-docosapentaenoateChEBI
16,17(S)-dihydroxy-ω3-docosapentaenoateChEBI
(7Z,10Z,12E,14E,17S,19Z)-16,17-dihydroxydocosapentaenoateChEBI
(PD)2n-3 DPA(1−)ChEBI
PD2n-3 DPA(1−)ChEBI