CHEBI:171183 - TG(14:1(9Z)/20:0/18:4(6Z,9Z,12Z,15Z))

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ChEBI Name TG(14:1(9Z)/20:0/18:4(6Z,9Z,12Z,15Z))
ChEBI ID CHEBI:171183
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C55H96O6
Net Charge 0
Average Mass 853.367
Monoisotopic Mass 852.72069
InChI InChI=1S/C55H96O6/c1-4-7-10-13-16-19-22-24-26-27-29-31-34-37-40-43-46-49-55(58)61-52(50-59-53(56)47-44-41-38-35-32-21-18-15-12-9-6-3)51-60-54(57)48-45-42-39-36-33-30-28-25-23-20-17-14-11-8-5-2/h8,11,15,17-18,20,25,28,33,36,52H,4-7,9-10,12-14,16,19,21-24,26-27,29-32,34-35,37-51H2,1-3H3/b11-8-,18-15-,20-17-,28-25-,36-33-/t52-/m0/s1
InChIKey QATNEARFLCYVEE-JVUXECHJSA-N
SMILES O(C(=O)CCCCCCCCCCCCCCCCCCC)[C@@H](COC(=O)CCCCCCC/C=C\CCCC)COC(=O)CCCC/C=C\C/C=C\C/C=C\C/C=C\CC
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 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
Homo sapiens (NCBI:txid9606) Found in Hepa-RG cell (BTO:0005736). of strain [] See: MetaboLights Study
ChEBI Ontology
Outgoing TG(14:1(9Z)/20:0/18:4(6Z,9Z,12Z,15Z)) (CHEBI:171183) is a triglyceride (CHEBI:17855)
IUPAC Name
[(2S)-1-[(6Z,9Z,12Z,15Z)-octadeca-6,9,12,15-tetraenoyl]oxy-3-[(Z)-tetradec-9-enoyl]oxypropan-2-yl] icosanoate
Manual Xrefs Databases
59656999 ChemSpider
HMDB0047833 HMDB
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