EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:189620 - TG(55:0)

ChEBI IDCHEBI:189620
ChEBI NameTG(55:0)
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC58H112O6
Net Charge0
Average Mass905.528
Monoisotopic Mass904.84589
SMILESCCCCCCCCCCCCCCCCCCCCC(=O)OC[C@@H](COC(=O)CCCCCCCCCCCC)OC(=O)CCCCCCCCCCCCCCCCCCCC
InChIInChI=1S/C58H112O6/c1-4-7-10-13-16-19-22-24-26-28-30-32-34-36-39-42-45-48-51-57(60)63-54-55(53-62-56(59)50-47-44-41-38-21-18-15-12-9-6-3)64-58(61)52-49-46-43-40-37-35-33-31-29-27-25-23-20-17-14-11-8-5-2/h55H,4-54H2,1-3H3/t55-/m1/s1
InChIKeyJBMDCQTTXDFBLA-KZRJWCEASA-N
Species of MetaboliteComponentSourceComments
Mus musculus (ncbitaxon:10090)
liver (BTO:0000759) MetaboLights (MTBLS1887)
heart (BTO:0000562) MetaboLights (MTBLS1887)
serum (BTO:0000133) MetaboLights (MTBLS1887)
ChEBI Ontology
Outgoing Relation(s)
TG(55:0) (CHEBI:189620) is a triglyceride (CHEBI:17855)
IUPAC Name 
[(2R)-2-henicosanoyloxy-3-tridecanoyloxypropyl] henicosanoate
Manual XrefsDatabases
LMGL03012745LIPID MAPS
HMDB0064603HMDB
59667162ChemSpider