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

ChEBI IDCHEBI:138602
ChEBI Name7(S)-hydroperoxy-17(R)-hydroxydocosahexaenoic acid
Stars
ASCII Name7(S)-hydroperoxy-17(R)-hydroxydocosahexaenoic acid
DefinitionA 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.
Last Modified24 January 2023
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@H](C/C=C\CCC(=O)O)OO
InChIInChI=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
InChIKeyCEMNNVWBEJGCOI-NXPQULCPSA-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)
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  Source
7(S)-Hp-17(R)-HDHASUBMITTER
7S-hydroperoxy-17R-HDHAChEBI
7S-hydroperoxy-17R-hydroxy-DHAChEBI
7S-hydroperoxy-17R-hydroxydocosahexaenoic acidChEBI
Citations