CHEBI:171557 - TG(15:0/22:1(13Z)/15:0)

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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(15:0/22:1(13Z)/15:0)
ChEBI ID CHEBI:171557
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C55H104O6
Net Charge 0
Average Mass 861.431
Monoisotopic Mass 860.78329
InChI InChI=1S/C55H104O6/c1-4-7-10-13-16-19-22-25-26-27-28-29-30-31-34-37-40-43-46-49-55(58)61-52(50-59-53(56)47-44-41-38-35-32-23-20-17-14-11-8-5-2)51-60-54(57)48-45-42-39-36-33-24-21-18-15-12-9-6-3/h25-26,52H,4-24,27-51H2,1-3H3/b26-25-
InChIKey MVBQFGCTCWSIBF-QPLCGJKRSA-N
SMILES O(C(COC(=O)CCCCCCCCCCCCCC)COC(=O)CCCCCCCCCCCCCC)C(=O)CCCCCCCCCCC/C=C\CCCCCCCC
Metabolite of Species Details
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). See: MetaboLights Study
Homo sapiens (NCBI:txid9606) Found in HeLa cell (BTO:0000567). See: MetaboLights Study
Homo sapiens (NCBI:txid9606) Found in HeLa cell;NIH-3T3 cell (BTO:0000944). See: MetaboLights Study
Homo sapiens (NCBI:txid9606) Found in NIH-3T3 cell (BTO:0000944). See: MetaboLights Study
ChEBI Ontology
Outgoing TG(15:0/22:1(13Z)/15:0) (CHEBI:171557) is a triglyceride (CHEBI:17855)
IUPAC Name
1,3-di(pentadecanoyloxy)propan-2-yl (Z)-docos-13-enoate
Manual Xrefs Databases
30777694 ChemSpider
HMDB0043337 HMDB
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