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CHEBI:196942 - TG(13:0/17:2(9Z,12Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z))[iso6]

ChEBI IDCHEBI:196942
ChEBI NameTG(13:0/17:2(9Z,12Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z))[iso6]
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC55H90O6
Net Charge0
Average Mass847.319
Monoisotopic Mass846.67374
SMILESCC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCC(=O)OC[C@@H](COC(=O)CCCCCCCCCCCC)OC(=O)CCCCCCC/C=C\C/C=C\CCCC
InChIInChI=1S/C55H90O6/c1-4-7-10-13-16-19-22-24-26-27-28-29-30-32-33-36-39-42-45-48-54(57)60-51-52(50-59-53(56)47-44-41-38-35-21-18-15-12-9-6-3)61-55(58)49-46-43-40-37-34-31-25-23-20-17-14-11-8-5-2/h7,10,14,16-17,19,23-26,28-29,32-33,39,42,52H,4-6,8-9,11-13,15,18,20-22,27,30-31,34-38,40-41,43-51H2,1-3H3/b10-7-,17-14-,19-16-,25-23-,26-24-,29-28-,33-32-,42-39-/t52-/m1/s1
InChIKeyFWABLWGTXPENFB-WLHIZYDGSA-N
ChEBI Ontology
Outgoing Relation(s)
TG(13:0/17:2(9Z,12Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z))[iso6] (CHEBI:196942) is a triglyceride (CHEBI:17855)
IUPAC Name 
[(2R)-2-[(9Z,12Z)-heptadeca-9,12-dienoyl]oxy-3-tridecanoyloxypropyl] (4Z,7Z,10Z,13Z,16Z,19Z)-docosa-4,7,10,13,16,19-hexaenoate
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