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CHEBI:138601 - 4(S)-hydroperoxy-17(R)-hydroxydocosahexaenoic acid

Default Structure
ChEBI IDCHEBI:138601
ChEBI Name4(S)-hydroperoxy-17(R)-hydroxydocosahexaenoic acid
Stars
ASCII Name4(S)-hydroperoxy-17(R)-hydroxydocosahexaenoic acid
DefinitionA hydroperoxy fatty acid that is (5E,7Z,10Z,13Z,15E,19Z)-docosa-5,7,10,13,15,19-hexaenoic acid carrying a hydroperoxy group at the 4S-position and a hydroxy group at the 17R-position.
Last Modified14 April 2026
SubmitterBijay
DownloadsMolfile
FormulaC22H32O5
Net Charge0
Average Mass376.493
Monoisotopic Mass376.22497
SMILESCC/C=C\C[C@@H](O)/C=C/C=C\C/C=C\C/C=C\C=C\[C@H](CCC(=O)O)OO
InChIInChI=1S/C22H32O5/c1-2-3-12-15-20(23)16-13-10-8-6-4-5-7-9-11-14-17-21(27-26)18-19-22(24)25/h3-5,8-14,16-17,20-21,23,26H,2,6-7,15,18-19H2,1H3,(H,24,25)/b5-4-,10-8-,11-9-,12-3-,16-13+,17-14+/t20-,21-/m1/s1
InChIKeyZKUDWLWHTKEJGJ-VDOHSOROSA-N
Roles Classification
Chemical Roles:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
Biological Roles:
metabolite  Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
metabolite  Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
ChEBI Ontology
Outgoing Relation(s)
4(S)-hydroperoxy-17(R)-hydroxydocosahexaenoic acid (CHEBI:138601) has role metabolite (CHEBI:25212)
4(S)-hydroperoxy-17(R)-hydroxydocosahexaenoic acid (CHEBI:138601) is a hydroperoxydocosahexaenoic acid (CHEBI:189831)
4(S)-hydroperoxy-17(R)-hydroxydocosahexaenoic acid (CHEBI:138601) is a hydroxydocosahexaenoic acid (CHEBI:72790)
4(S)-hydroperoxy-17(R)-hydroxydocosahexaenoic acid (CHEBI:138601) is conjugate acid of 4(S)-hydroperoxy-17(R)-hydroxydocosahexaenoate (CHEBI:747573)
Incoming Relation(s)
4(S)-hydroperoxy-17(R)-hydroxydocosahexaenoate (CHEBI:747573) is conjugate base of 4(S)-hydroperoxy-17(R)-hydroxydocosahexaenoic acid (CHEBI:138601)
IUPAC Name 
(4S,5E,7Z,10Z,13Z,15E,17R,19Z)-4-hydroperoxy-17-hydroxydocosa-5,7,10,13,15,19-hexaenoic acid
Synonyms  Source
4(S)-Hp-17(R)-HDHASUBMITTER
4S-hydroperoxy-17R-HDHAChEBI
4(S)-hydroperoxy-17(R)-HDHAChEBI
4S-hydroperoxy-17R-hydroxy-DHAChEBI
Citations