CHEBI:170445 - TG(20:3(5Z,8Z,11Z)/16:0/20:3(5Z,8Z,11Z))

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ChEBI Name TG(20:3(5Z,8Z,11Z)/16:0/20:3(5Z,8Z,11Z))
ChEBI ID CHEBI:170445
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C59H102O6
Net Charge 0
Average Mass 907.459
Monoisotopic Mass 906.76764
InChI InChI=1S/C59H102O6/c1-4-7-10-13-16-19-22-25-27-29-31-34-36-39-42-45-48-51-57(60)63-54-56(65-59(62)53-50-47-44-41-38-33-24-21-18-15-12-9-6-3)55-64-58(61)52-49-46-43-40-37-35-32-30-28-26-23-20-17-14-11-8-5-2/h25-28,31-32,34-35,39-40,42-43,56H,4-24,29-30,33,36-38,41,44-55H2,1-3H3/b27-25-,28-26-,34-31-,35-32-,42-39-,43-40-
InChIKey VNZYRMQWKVVKIT-KMRKUHDFSA-N
SMILES O(C(=O)CCCCCCCCCCCCCCC)C(COC(=O)CCC/C=C\C/C=C\C/C=C\CCCCCCCC)COC(=O)CCC/C=C\C/C=C\C/C=C\CCCCCCCC
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 HeLa cell;NIH-3T3 cell (BTO:0000944). 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(20:3(5Z,8Z,11Z)/16:0/20:3(5Z,8Z,11Z)) (CHEBI:170445) is a triglyceride (CHEBI:17855)
IUPAC Name
[2-hexadecanoyloxy-3-[(5Z,8Z,11Z)-icosa-5,8,11-trienoyl]oxypropyl] (5Z,8Z,11Z)-icosa-5,8,11-trienoate
Manual Xrefs Databases
30777987 ChemSpider
HMDB0050905 HMDB
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