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CHEBI:189624 - TG(59:9)

ChEBI IDCHEBI:189624
ChEBI NameTG(59:9)
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC62H102O6
Net Charge0
Average Mass943.492
Monoisotopic Mass942.76764
SMILESCC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCCC(=O)O[C@H](COC(=O)CCCC/C=C\C/C=C\C/C=C\C/C=C\CC)COC(=O)CCCCCCCCCCCCCCCCCCCC
InChIInChI=1S/C62H102O6/c1-4-7-10-13-16-19-22-25-28-30-32-34-37-40-43-46-49-52-55-61(64)67-58-59(57-66-60(63)54-51-48-45-42-39-36-33-27-24-21-18-15-12-9-6-3)68-62(65)56-53-50-47-44-41-38-35-31-29-26-23-20-17-14-11-8-5-2/h8-9,11-12,17-18,20-21,26-27,29,33,35,38-39,42,44,47,59H,4-7,10,13-16,19,22-25,28,30-32,34,36-37,40-41,43,45-46,48-58H2,1-3H3/b11-8-,12-9-,20-17-,21-18-,29-26-,33-27-,38-35-,42-39-,47-44-/t59-/m1/s1
InChIKeyQQQXMVPOUJSUHP-XHSWFERZSA-N
Species of MetaboliteComponentSourceComments
Mus musculus (ncbitaxon:10090)
serum (BTO:0000133) MetaboLights (MTBLS1887)
heart (BTO:0000562) MetaboLights (MTBLS1887)
liver (BTO:0000759) MetaboLights (MTBLS1887)
ChEBI Ontology
Outgoing Relation(s)
TG(59:9) (CHEBI:189624) is a triglyceride (CHEBI:17855)
IUPAC Name 
[(2S)-2-[(5Z,8Z,11Z,14Z,17Z)-icosa-5,8,11,14,17-pentaenoyl]oxy-3-[(6Z,9Z,12Z,15Z)-octadeca-6,9,12,15-tetraenoyl]oxypropyl] henicosanoate
Manual XrefsDatabases
LMGL03016638LIPID MAPS
113374546ChemSpider