CHEBI:171531 - TG(19:0/i-13:0/i-16:0)

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This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.
ChEBI Name TG(19:0/i-13:0/i-16:0)
ChEBI ID CHEBI:171531
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C51H98O6
Net Charge 0
Average Mass 807.339
Monoisotopic Mass 806.73634
InChI InChI=1S/C51H98O6/c1-6-7-8-9-10-11-12-13-14-15-16-17-21-26-31-36-41-49(52)55-44-48(57-51(54)43-38-33-28-23-25-30-35-40-47(4)5)45-56-50(53)42-37-32-27-22-19-18-20-24-29-34-39-46(2)3/h46-48H,6-45H2,1-5H3/t48-/m0/s1
InChIKey HDBMFFQTIRWPNC-DYVQZXGMSA-N
SMILES O([C@@H](COC(=O)CCCCCCCCCCCCCCCCCC)COC(=O)CCCCCCCCCCCCC(C)C)C(=O)CCCCCCCCCC(C)C
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 HeLa cell (BTO:0000567). of strain [] 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 NIH-3T3 cell (BTO:0000944). of strain [] See: MetaboLights Study
Homo sapiens (NCBI:txid9606) Found in HeLa cell;NIH-3T3 cell (BTO:0000944). of strain [] See: MetaboLights Study
ChEBI Ontology
Outgoing TG(19:0/i-13:0/i-16:0) (CHEBI:171531) is a triglyceride (CHEBI:17855)
IUPAC Name
[(2S)-2-(11-methyldodecanoyloxy)-3-(14-methylpentadecanoyloxy)propyl] nonadecanoate
Manual Xrefs Databases
74873733 ChemSpider
HMDB0109853 HMDB
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