CHEBI:72794 - 11-HDoHE

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name 11-HDoHE
ChEBI ID CHEBI:72794
Definition A hydroxydocosahexaenoic acid that consists of 4Z,7Z,9E,13Z,16Z,19Z-docosahexaenoic acid with the hydroxy group located at position 11.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information No supplier information found for this compound.
Download Molfile XML SDF
Formula C22H32O3
Net Charge 0
Average Mass 344.48770
Monoisotopic Mass 344.23514
InChI InChI=1S/C22H32O3/c1-2-3-4-5-6-7-9-12-15-18-21(23)19-16-13-10-8-11-14-17-20-22(24)25/h3-4,6-7,10-16,19,21,23H,2,5,8-9,17-18,20H2,1H3,(H,24,25)/b4-3-,7-6-,13-10-,14-11-,15-12-,19-16+
InChIKey LTERDCBCHFKFRI-BGKMTWLOSA-N
SMILES CC\C=C/C\C=C/C\C=C/CC(O)\C=C\C=C/C\C=C/CCC(O)=O
Roles Classification
Chemical Role(s): Bronsted acid
A molecular entity capable of donating a hydron to an acceptor (Bronsted base).
(via oxoacid )
Biological Role(s): metabolite
Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
(via hydroxydocosahexaenoic acid )
View more via ChEBI Ontology
ChEBI Ontology
Outgoing 11-HDoHE (CHEBI:72794) has role metabolite (CHEBI:25212)
11-HDoHE (CHEBI:72794) is a hydroxydocosahexaenoic acid (CHEBI:72790)
IUPAC Name
(4Z,7Z,9E,13Z,16Z,19Z)-11-hydroxydocosa-4,7,9,13,16,19-hexaenoic acid
Synonyms Sources
(±)-11-HDoHE LIPID MAPS
(±)-11-hydroxy-4Z,7Z,9E,13Z,16Z,19Z-docosahexaenoic acid LIPID MAPS
11-hydroxy DHA ChEBI
Manual Xref Database
LMFA04000028 LIPID MAPS
View more database links
Registry Number Type Source
14554717 Reaxys Registry Number Reaxys
Last Modified
23 October 2015