CHEBI:170944 - TG(14:1(9Z)/18:1(11Z)/22:2(13Z,16Z))

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ChEBI Name TG(14:1(9Z)/18:1(11Z)/22:2(13Z,16Z))
ChEBI ID CHEBI:170944
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C57H102O6
Net Charge 0
Average Mass 883.437
Monoisotopic Mass 882.76764
InChI InChI=1S/C57H102O6/c1-4-7-10-13-16-19-22-24-26-27-28-29-31-32-35-38-41-44-47-50-56(59)62-53-54(52-61-55(58)49-46-43-40-37-34-21-18-15-12-9-6-3)63-57(60)51-48-45-42-39-36-33-30-25-23-20-17-14-11-8-5-2/h15-16,18-20,23-24,26,54H,4-14,17,21-22,25,27-53H2,1-3H3/b18-15-,19-16-,23-20-,26-24-/t54-/m0/s1
InChIKey XUSMNDFFJSIIQR-PVVBFDGQSA-N
SMILES O([C@H](COC(=O)CCCCCCCCCCC/C=C\C/C=C\CCCCC)COC(=O)CCCCCCC/C=C\CCCC)C(=O)CCCCCCCCC/C=C\CCCCCC
Metabolite of Species Details
reference compound Found in mixture (CHEBI:60004). of strain [] See: MetaboLights Study
reference compound Found in mixture (CHEBI:60004). of strain [] See: MetaboLights Study
Mus musculus (NCBI:txid10090) Found in Hepa-RG cell (BTO:0005736). of strain C57BL/6J [EFO:0000606] See: MetaboLights Study
Homo sapiens (NCBI:txid9606) Found in Hepa-RG cell (BTO:0005736). of strain [] See: MetaboLights Study
Homo sapiens (NCBI:txid9606) Found in HeLa cell;NIH-3T3 cell (BTO:0000944). of strain [] See: MetaboLights Study
Homo sapiens (NCBI:txid9606) Found in HeLa cell (BTO:0000567). of strain [] See: MetaboLights Study
Homo sapiens (NCBI:txid9606) Found in NIH-3T3 cell (BTO:0000944). of strain [] See: MetaboLights Study
ChEBI Ontology
Outgoing TG(14:1(9Z)/18:1(11Z)/22:2(13Z,16Z)) (CHEBI:170944) is a triglyceride (CHEBI:17855)
IUPAC Name
[(2R)-2-[(Z)-octadec-11-enoyl]oxy-3-[(Z)-tetradec-9-enoyl]oxypropyl] (13Z,16Z)-docosa-13,16-dienoate
Manual Xrefs Databases
59657105 ChemSpider
HMDB0047944 HMDB
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