CHEBI:137346 - (14R)-HDoHE

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name (14R)-HDoHE
ChEBI ID CHEBI:137346
ChEBI ASCII Name (14R)-HDoHE
Definition A 14-HDoHE in which the stereocentre at position 14 has R-configuration.
Stars This entity has been manually annotated by the ChEBI Team.
Submitter Bijay
Secondary ChEBI IDs CHEBI:140212
Supplier Information ZINC000030729497
Download Molfile XML SDF
Formula C22H32O3
Net Charge 0
Average Mass 344.489
Monoisotopic Mass 344.23514
InChI InChI=1S/C22H32O3/c1-2-3-4-5-12-15-18-21(23)19-16-13-10-8-6-7-9-11-14-17-20-22(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+/t21-/m1/s1
InChIKey ZNEBXONKCYFJAF-MBRSJONVSA-N
SMILES C(C(O)=O)C/C=C\C/C=C\C\C=C/C=C/[C@@H](C/C=C\C/C=C\CC)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): human xenobiotic metabolite
Any human metabolite produced by metabolism of a xenobiotic compound in humans.
(via 14-HDoHE )
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 (14R)-HDoHE (CHEBI:137346) is a 14-HDoHE (CHEBI:72647)
(14R)-HDoHE (CHEBI:137346) is conjugate acid of (14R)-HDoHE(1−) (CHEBI:136525)
(14R)-HDoHE (CHEBI:137346) is enantiomer of (14S)-HDoHE (CHEBI:137347)
Incoming (14R)-HDoHE(1−) (CHEBI:136525) is conjugate base of (14R)-HDoHE (CHEBI:137346)
(14S)-HDoHE (CHEBI:137347) is enantiomer of (14R)-HDoHE (CHEBI:137346)
IUPAC Name
(4Z,7Z,10Z,12E,14R,16Z,19Z)-14-hydroxydocosa-4,7,10,12,16,19-hexaenoic acid
Synonyms Sources
(14R)-HDHA ChEBI
(14R)-hydroxy-(4Z,7Z,10Z,12E,16Z,19Z)-docosahexaenoic acid ChEBI
(4Z,7Z,10Z,12E,14R,16Z,19Z)-14-hydroxydocosahexaenoic acid ChEBI
14(R)-HDHA SUBMITTER
14(R)-HDoHE ChEBI
Registry Number Type Source
27627498 Reaxys Registry Number Reaxys
Citations Types Sources
19965612 PubMed citation Europe PMC
25200603 PubMed citation Europe PMC
Last Modified
22 February 2018