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CHEBI:179070 - DG(18:2n6/0:0/20:5n3)

ChEBI IDCHEBI:179070
ChEBI NameDG(18:2n6/0:0/20:5n3)
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SubmitterMetaboLights
DownloadsMolfile
FormulaC42H68O5
Net Charge0
Average Mass653.001
Monoisotopic Mass652.50668
SMILESCC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCCC(=O)OC[C@H](O)COC(=O)CCCCCCC/C=C\C/C=C\CCCCCC
InChIInChI=1S/C42H68O5/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-35-37-42(45)47-39-40(43)38-46-41(44)36-34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h5,7,11,13-14,16-17,19-20,22-23,25,29,31,40,43H,3-4,6,8-10,12,15,18,21,24,26-28,30,32-39H2,1-2H3/b7-5-,13-11-,16-14-,19-17-,22-20-,25-23-,31-29-/t40-/m1/s1
InChIKeyMZLFNAOAXRHIHL-GPDNOACASA-N
ChEBI Ontology
Outgoing Relation(s)
DG(18:2n6/0:0/20:5n3) (CHEBI:179070) is a icosanoid (CHEBI:23899)
IUPAC Name 
[(2R)-2-hydroxy-3-[(9Z,12Z)-nonadeca-9,12-dienoyl]oxypropyl] (5Z,8Z,11Z,14Z,17Z)-icosa-5,8,11,14,17-pentaenoate
Manual XrefsDatabases
HMDB0056293HMDB
74854640ChemSpider