CHEBI:185956 - TG(14:1(9Z)/14:1(9Z)/22:4(7Z,10Z,13Z,16Z))[iso3]

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ChEBI Name TG(14:1(9Z)/14:1(9Z)/22:4(7Z,10Z,13Z,16Z))[iso3]
ChEBI ID CHEBI:185956
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
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Formula C53H90O6
Net Charge 0
Average Mass 823.297
Monoisotopic Mass 822.67374
InChI InChI=1S/C53H90O6/c1-4-7-10-13-16-19-22-23-24-25-26-27-28-29-32-34-37-40-43-46-52(55)58-49-50(59-53(56)47-44-41-38-35-31-21-18-15-12-9-6-3)48-57-51(54)45-42-39-36-33-30-20-17-14-11-8-5-2/h14-19,23-24,26-27,29,32,50H,4-13,20-22,25,28,30-31,33-49H2,1-3H3/b17-14-,18-15-,19-16-,24-23-,27-26-,32-29-/t50-/m1/s1
InChIKey UPZFPCJGSVTLNQ-YRACUENASA-N
SMILES O([C@H](COC(=O)CCCCCCC/C=C\CCCC)COC(=O)CCCCC/C=C\C/C=C\C/C=C\C/C=C\CCCCC)C(=O)CCCCCCC/C=C\CCCC
Metabolite of Species Details
Mus musculus (NCBI:txid10090) Found in feces (BTO:0000440). of strain C57BL/6 Mouse [NCIT:C14424] See: MetaboLights Study
ChEBI Ontology
Outgoing TG(14:1(9Z)/14:1(9Z)/22:4(7Z,10Z,13Z,16Z))[iso3] (CHEBI:185956) is a triglyceride (CHEBI:17855)
IUPAC Name
[(2R)-2,3-bis[[(Z)-tetradec-9-enoyl]oxy]propyl] (7Z,10Z,13Z,16Z)-docosa-7,10,13,16-tetraenoate
Manual Xrefs Databases
113371564 ChemSpider
LMGL03012839 LIPID MAPS
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