EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:179140 - MG(22:5(4Z,7Z,10Z,13Z,16Z)/0:0/0:0)

ChEBI IDCHEBI:179140
ChEBI NameMG(22:5(4Z,7Z,10Z,13Z,16Z)/0:0/0:0)
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC25H40O4
Net Charge0
Average Mass404.591
Monoisotopic Mass404.29266
SMILESCCCCC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCC(=O)OC[C@@H](O)CO
InChIInChI=1S/C25H40O4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-25(28)29-23-24(27)22-26/h6-7,9-10,12-13,15-16,18-19,24,26-27H,2-5,8,11,14,17,20-23H2,1H3/b7-6-,10-9-,13-12-,16-15-,19-18-/t24-/m0/s1
InChIKeyHDIQCISTZKHUDO-AJWITYRPSA-N
ChEBI Ontology
Outgoing Relation(s)
MG(22:5(4Z,7Z,10Z,13Z,16Z)/0:0/0:0) (CHEBI:179140) is a 1-monoglyceride (CHEBI:35759)
IUPAC Name 
[(2S)-2,3-dihydroxypropyl] (4Z,7Z,10Z,13Z,16Z)-docosa-4,7,10,13,16-pentaenoate
Manual XrefsDatabases
24765803ChemSpider
HMDB0011585HMDB