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CHEBI:165248 - 13,14-DiHDPE

Default Structure
ChEBI IDCHEBI:165248
ChEBI Name13,14-DiHDPE
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC22H34O4
Net Charge0
Average Mass362.510
Monoisotopic Mass362.24571
SMILESCC/C=C\C/C=C\CC(O)C(O)C/C=C\C/C=C\C/C=C\CCC(=O)O
InChIInChI=1S/C22H34O4/c1-2-3-4-5-11-14-17-20(23)21(24)18-15-12-9-7-6-8-10-13-16-19-22(25)26/h3-4,6-7,10-15,20-21,23-24H,2,5,8-9,16-19H2,1H3,(H,25,26)/b4-3-,7-6-,13-10-,14-11-,15-12-
InChIKeyLINXWSBRRJSWHL-UQZHZJRSSA-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)
13,14-DiHDPE (CHEBI:165248) is a very long-chain fatty acid (CHEBI:27283)
IUPAC Name 
(4Z,7Z,10Z,16Z,19Z)-13,14-dihydroxydocosa-4,7,10,16,19-pentaenoic acid
Manual XrefsDatabases
17220825ChemSpider
LMFA04000041LIPID MAPS