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CHEBI:132025 - 21-HDoHE(1−)

Default Structure
ChEBI IDCHEBI:132025
ChEBI Name21-HDoHE(1−)
Stars
ASCII Name21-HDoHE(1-)
DefinitionAn (ω-1)-hydroxy fatty acid anion that is the conjugate base of 21-HDoHE, obtained by deprotonation of the carboxy group; major species at pH 7.3.
Last Modified30 June 2016
Submitternhn
DownloadsMolfile
FormulaC22H31O3
Net Charge-1
Average Mass343.487
Monoisotopic Mass343.22787
SMILESCC(O)/C=C\C/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCC(=O)[O-]
InChIInChI=1S/C22H32O3/c1-21(23)19-17-15-13-11-9-7-5-3-2-4-6-8-10-12-14-16-18-20-22(24)25/h2,4-5,7-8,10-11,13-14,16-17,19,21,23H,3,6,9,12,15,18,20H2,1H3,(H,24,25)/p-1/b4-2-,7-5-,10-8-,13-11-,16-14-,19-17-
InChIKeyIXAMNXQQWDOFMN-NZONWQNASA-M
ChEBI Ontology
Outgoing Relation(s)
21-HDoHE(1−) (CHEBI:132025) is a (ω−1)-hydroxy fatty acid anion (CHEBI:84497)
21-HDoHE(1−) (CHEBI:132025) is a hydroxydocosahexaenoate (CHEBI:131867)
21-HDoHE(1−) (CHEBI:132025) is a long-chain fatty acid anion (CHEBI:57560)
21-HDoHE(1−) (CHEBI:132025) is conjugate base of 21-HDoHE (CHEBI:132325)
Incoming Relation(s)
21-HDoHE (CHEBI:132325) is conjugate acid of 21-HDoHE(1−) (CHEBI:132025)
IUPAC Name 
(4Z,7Z,10Z,13Z,16Z,19Z)-21-hydroxydocosa-4,7,10,13,16,19-hexaenoate
Synonyms  Source
21-HDHA(1−)SUBMITTER
(4Z,7Z,10Z,13Z,16Z,19Z)-21-hydroxydocosahexaenoateChEBI
UniProt Name  Source
21-hydroxy-(4Z,7Z,10Z,13Z,16Z,19Z)-docosahexaenoateUniProt
Citations