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CHEBI:188388 - 22:1(5Z)(13Me,17Me,21Me)

ChEBI IDCHEBI:188388
ChEBI Name22:1(5Z)(13Me,17Me,21Me)
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC25H48O2
Net Charge0
Average Mass380.657
Monoisotopic Mass380.36543
SMILESCC(C)CCCC(C)CCCC(C)CCCCCC/C=C\CCCC(=O)O
InChIInChI=1S/C25H48O2/c1-22(2)16-14-18-24(4)20-15-19-23(3)17-12-10-8-6-5-7-9-11-13-21-25(26)27/h7,9,22-24H,5-6,8,10-21H2,1-4H3,(H,26,27)/b9-7-
InChIKeyGNJWUBJYELNMEO-CLFYSBASSA-N
Species of MetaboliteComponentSourceComments
Mus musculus (ncbitaxon:10090) blood serum (BTO:0000133) MetaboLights (MTBLS3886)
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
ChEBI Ontology
Outgoing Relation(s)
22:1(5Z)(13Me,17Me,21Me) (CHEBI:188388) is a very long-chain fatty acid (CHEBI:27283)
IUPAC Name 
(Z)-13,17,21-trimethyldocos-5-enoic acid
Manual XrefsDatabases
113368973ChemSpider