CHEBI:184958 - TG(14:0/18:2(9Z,12Z)/20:0)

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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(14:0/18:2(9Z,12Z)/20:0)
ChEBI ID CHEBI:184958
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C55H102O6
Net Charge 0
Average Mass 859.415
Monoisotopic Mass 858.76764
InChI InChI=1S/C55H102O6/c1-4-7-10-13-16-19-22-24-26-27-29-30-33-36-39-42-45-48-54(57)60-51-52(50-59-53(56)47-44-41-38-35-32-21-18-15-12-9-6-3)61-55(58)49-46-43-40-37-34-31-28-25-23-20-17-14-11-8-5-2/h17,20,25,28,52H,4-16,18-19,21-24,26-27,29-51H2,1-3H3/b20-17-,28-25-/t52-/m1/s1
InChIKey TXMWKTABZBAJCW-QLHBUVOUSA-N
SMILES O(C(=O)CCCCCCCCCCCCCCCCCCC)C[C@H](OC(=O)CCCCCCC/C=C\C/C=C\CCCCC)COC(=O)CCCCCCCCCCCCC
Metabolite of Species Details
Bos taurus (NCBI:txid9913) Found in spermatozoon (BTO:0001277). of strain Holstein [LBO:0000132] See: MetaboLights Study
ChEBI Ontology
Outgoing TG(14:0/18:2(9Z,12Z)/20:0) (CHEBI:184958) is a triglyceride (CHEBI:17855)
IUPAC Name
[(2R)-2-[(9Z,12Z)-octadeca-9,12-dienoyl]oxy-3-tetradecanoyloxypropyl] icosanoate
Manual Xrefs Databases
75320246 ChemSpider
LMGL03014387 LIPID MAPS
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