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CHEBI:140234 - 7,8-epoxy,17-hydroxy-(9E,11E,13Z,15E,19Z)-docosapentaenoic acid

ChEBI IDCHEBI:140234
ChEBI Name7,8-epoxy,17-hydroxy-(9E,11E,13Z,15E,19Z)-docosapentaenoic acid
Stars
ASCII Name7,8-epoxy,17-hydroxy-(9E,11E,13Z,15E,19Z)-docosapentaenoic acid
DefinitionA docosanoid that is (9E,11E,13Z,15E,19Z)-docosapentaenoic acid carrying an epoxy group across positions 7 and 8 as well as a hydroxy substituent at position 17. An intermediate of specialised proresolving mediators.
Last Modified5 March 2018
SubmitterBijay
DownloadsMolfile
FormulaC22H32O4
Net Charge0
Average Mass360.494
Monoisotopic Mass360.23006
SMILESCC/C=C\CC(O)/C=C/C=C\C=C\C=C\C1OC1CCCCCC(=O)O
InChIInChI=1S/C22H32O4/c1-2-3-9-14-19(23)15-10-6-4-5-7-11-16-20-21(26-20)17-12-8-13-18-22(24)25/h3-7,9-11,15-16,19-21,23H,2,8,12-14,17-18H2,1H3,(H,24,25)/b6-4-,7-5+,9-3-,15-10+,16-11+
InChIKeyBZKRUVANVNUJOK-HBVUTLMMSA-N
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606) - PubMed (23736886)
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
Biological Role:
human xenobiotic metabolite  Any human metabolite produced by metabolism of a xenobiotic compound in humans.
ChEBI Ontology
Outgoing Relation(s)
7,8-epoxy,17-hydroxy-(9E,11E,13Z,15E,19Z)-docosapentaenoic acid (CHEBI:140234) has role human xenobiotic metabolite (CHEBI:76967)
7,8-epoxy,17-hydroxy-(9E,11E,13Z,15E,19Z)-docosapentaenoic acid (CHEBI:140234) is a docosanoid (CHEBI:131863)
7,8-epoxy,17-hydroxy-(9E,11E,13Z,15E,19Z)-docosapentaenoic acid (CHEBI:140234) is a epoxy fatty acid (CHEBI:61498)
7,8-epoxy,17-hydroxy-(9E,11E,13Z,15E,19Z)-docosapentaenoic acid (CHEBI:140234) is a hydroxy polyunsaturated fatty acid (CHEBI:140345)
7,8-epoxy,17-hydroxy-(9E,11E,13Z,15E,19Z)-docosapentaenoic acid (CHEBI:140234) is a long-chain fatty acid (CHEBI:15904)
7,8-epoxy,17-hydroxy-(9E,11E,13Z,15E,19Z)-docosapentaenoic acid (CHEBI:140234) is conjugate acid of 7,8-epoxy,17-hydroxy-(9E,11E,13Z,15E,19Z)-docosapentaenoate (CHEBI:140293)
Incoming Relation(s)
7,8-epoxy,17-hydroxy-(9E,11E,13Z,15E,19Z)-docosapentaenoate (CHEBI:140293) is conjugate base of 7,8-epoxy,17-hydroxy-(9E,11E,13Z,15E,19Z)-docosapentaenoic acid (CHEBI:140234)
IUPAC Name 
6-{3-[(1E,3E,5Z,7E,11Z)-9-hydroxytetradeca-1,3,5,7,11-pentaen-1-yl]oxiran-2-yl}hexanoic acid
Synonyms  Source
7,8-epoxy,17-HDPA(n−3)SUBMITTER
(9E,11E,13Z,15E,19Z)-7,8-epoxy,17-hydroxydocosapentaenoic acidChEBI
7,8-epoxy,17-hydroxy-ω−3-docosapentaenoic acidChEBI
Citations