EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:196695 - DG(18:3n3/0:0/20:4n3)

ChEBI IDCHEBI:196695
ChEBI NameDG(18:3n3/0:0/20:4n3)
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC41H66O5
Net Charge0
Average Mass638.974
Monoisotopic Mass638.49103
SMILESCC/C=C\C/C=C\C/C=C\C/C=C\CCCCCCC(=O)OC[C@H](O)COC(=O)CCCCCCC/C=C\C/C=C\C/C=C\CC
InChIInChI=1S/C41H66O5/c1-3-5-7-9-11-13-15-17-19-20-22-24-26-28-30-32-34-36-41(44)46-38-39(42)37-45-40(43)35-33-31-29-27-25-23-21-18-16-14-12-10-8-6-4-2/h5-8,11-14,17-19,21-22,24,39,42H,3-4,9-10,15-16,20,23,25-38H2,1-2H3/b7-5-,8-6-,13-11-,14-12-,19-17-,21-18-,24-22-/t39-/m1/s1
InChIKeyOXCBLCXMXYMXFP-OSAFNDQSSA-N
ChEBI Ontology
Outgoing Relation(s)
DG(18:3n3/0:0/20:4n3) (CHEBI:196695) is a icosanoid (CHEBI:23899)
IUPAC Name 
[(2R)-2-hydroxy-3-[(9Z,12Z,15Z)-octadeca-9,12,15-trienoyl]oxypropyl] (8Z,11Z,14Z,17Z)-icosa-8,11,14,17-tetraenoate
Manual XrefsDatabases
74854707ChemSpider
HMDB0056368HMDB