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CHEBI:136118 - (4Z,7Z,10Z,13Z,15E,17S)-17-hydroperoxydocosapentaenoic acid

ChEBI IDCHEBI:136118
ChEBI Name(4Z,7Z,10Z,13Z,15E,17S)-17-hydroperoxydocosapentaenoic acid
Stars
ASCII Name(4Z,7Z,10Z,13Z,15E,17S)-17-hydroperoxydocosapentaenoic acid
DefinitionA hydroperoxydocosapentaenoic acid that is (4Z,7Z,10Z,13Z,15E)-docosapentaenoic acid carrying a hydroperoxy substituent at position 17S.
Last Modified18 February 2022
SubmitterSteve
DownloadsMolfile
FormulaC22H34O4
Net Charge0
Average Mass362.510
Monoisotopic Mass362.24571
SMILESCCCCC[C@@H](/C=C/C=C\C/C=C\C/C=C\C/C=C\CCC(=O)O)OO
InChIInChI=1S/C22H34O4/c1-2-3-15-18-21(26-25)19-16-13-11-9-7-5-4-6-8-10-12-14-17-20-22(23)24/h5-8,11-14,16,19,21,25H,2-4,9-10,15,17-18,20H2,1H3,(H,23,24)/b7-5-,8-6-,13-11-,14-12-,19-16+/t21-/m0/s1
InChIKeyISPMDQHJXOPONJ-RUPKWMQGSA-N
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
ChEBI Ontology
Outgoing Relation(s)
(4Z,7Z,10Z,13Z,15E,17S)-17-hydroperoxydocosapentaenoic acid (CHEBI:136118) has functional parent (4Z,7Z,10Z,13Z,16Z)-docosa-4,7,10,13,16-pentaenoic acid (CHEBI:65136)
(4Z,7Z,10Z,13Z,15E,17S)-17-hydroperoxydocosapentaenoic acid (CHEBI:136118) is a hydroperoxydocosapentaenoic acid (CHEBI:189823)
(4Z,7Z,10Z,13Z,15E,17S)-17-hydroperoxydocosapentaenoic acid (CHEBI:136118) is conjugate acid of (4Z,7Z,10Z,13Z,15E,17S)-17-hydroperoxydocosapentaenoate (CHEBI:133796)
Incoming Relation(s)
(4Z,7Z,10Z,13Z,15E,17S)-17-hydroperoxydocosapentaenoate (CHEBI:133796) is conjugate base of (4Z,7Z,10Z,13Z,15E,17S)-17-hydroperoxydocosapentaenoic acid (CHEBI:136118)
IUPAC Name 
(4Z,7Z,10Z,13Z,15E,17S)-17-hydroperoxydocosa-4,7,10,13,15-pentaenoic acid
Synonyms  Source
(17S)-HPDPA(n-6)ChEBI
(17S)-hydroperoxy-(4Z,7Z,10Z,13Z,15E)-docosapentaenoic acidChEBI
(17S)-HPDoPE(n-6)ChEBI