CHEBI:138602 - 7(S)-hydroperoxy-17(R)-hydroxydocosahexaenoic acid

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name 7(S)-hydroperoxy-17(R)-hydroxydocosahexaenoic acid
ChEBI ID CHEBI:138602
ChEBI ASCII Name 7(S)-hydroperoxy-17(R)-hydroxydocosahexaenoic acid
Definition A hydroperoxy fatty acid that is (4Z,8E,10Z,13Z,15E,19Z)-docosa-4,8,10,13,15,19-hexaenoic acid carrying a hydroperoxy group at the 7S-position and a hydroxy group at the 17R-position. It is an intermediate involved in the resolvin D1 biosynthesis pathway.
Stars This entity has been manually annotated by the ChEBI Team.
Submitter Bijay
Supplier Information
Download Molfile XML SDF
Formula C22H32O5
Net Charge 0
Average Mass 376.493
Monoisotopic Mass 376.22497
InChI InChI=1S/C22H32O5/c1-2-3-10-15-20(23)16-11-7-5-4-6-8-12-17-21(27-26)18-13-9-14-19-22(24)25/h3,5-13,16-17,20-21,23,26H,2,4,14-15,18-19H2,1H3,(H,24,25)/b7-5-,8-6-,10-3-,13-9-,16-11+,17-12+/t20-,21-/m1/s1
InChIKey CEMNNVWBEJGCOI-NXPQULCPSA-N
SMILES C(\C/C=C\C=C\[C@H](C/C=C\CCC(=O)O)OO)=C\C=C\[C@H](O)C/C=C\CC
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 7(S)-hydroperoxy-17(R)-hydroxydocosahexaenoic acid (CHEBI:138602) has role metabolite (CHEBI:25212)
7(S)-hydroperoxy-17(R)-hydroxydocosahexaenoic acid (CHEBI:138602) is a hydroperoxy polyunsaturated fatty acid (CHEBI:189832)
7(S)-hydroperoxy-17(R)-hydroxydocosahexaenoic acid (CHEBI:138602) is a hydroxydocosahexaenoic acid (CHEBI:72790)
IUPAC Name
(4Z,7S,8E,10Z,13Z,15E,17R,19Z)-7-hydroperoxy-17-hydroxydocosa-4,8,10,13,15,19-hexaenoic acid
Synonyms Sources
7(S)-Hp-17(R)-HDHA SUBMITTER
7S-hydroperoxy-17R-HDHA ChEBI
7S-hydroperoxy-17R-hydroxy-DHA ChEBI
7S-hydroperoxy-17R-hydroxydocosahexaenoic acid ChEBI
Citations Waiting for Citations Types Sources
17244615 PubMed citation Europe PMC
22087354 PubMed citation Europe PMC
Last Modified
24 January 2023