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CHEBI:165269 - 20-Hydroxy-Resolvin E1

ChEBI IDCHEBI:165269
ChEBI Name20-Hydroxy-Resolvin E1
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SubmitterMetaboLights
DownloadsMolfile
FormulaC20H30O6
Net Charge0
Average Mass366.454
Monoisotopic Mass366.20424
SMILESO=C(O)CCC[C@H](O)/C=C\C=C\C=C\[C@H](O)C/C=C\C=C\[C@@H](O)CCO
InChIInChI=1S/C20H30O6/c21-16-15-19(24)12-7-3-6-11-17(22)9-4-1-2-5-10-18(23)13-8-14-20(25)26/h1-7,9-10,12,17-19,21-24H,8,11,13-16H2,(H,25,26)/b2-1+,6-3-,9-4+,10-5-,12-7+/t17-,18+,19+/m0/s1
InChIKeyJTGJRDREFMAMJA-MPPNEBGGSA-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 Role:
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)
20-Hydroxy-Resolvin E1 (CHEBI:165269) is a HEPE (CHEBI:72799)
IUPAC Name 
(5S,6Z,8E,10E,12R,14Z,16E,18S)-5,12,18,20-tetrahydroxyicosa-6,8,10,14,16-pentaenoic acid
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