EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:172842 - TG(15:0/20:0/o-18:0)

ChEBI IDCHEBI:172842
ChEBI NameTG(15:0/20:0/o-18:0)
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC56H110O5
Net Charge0
Average Mass863.491
Monoisotopic Mass862.83533
SMILESCCCCCCCCCCCCCCCCCCCC(=O)O[C@H](COCCCCCCCCCCCCCCCCCC)COC(=O)CCCCCCCCCCCCCC
InChIInChI=1S/C56H110O5/c1-4-7-10-13-16-19-22-25-27-29-30-32-35-38-41-44-47-50-56(58)61-54(53-60-55(57)49-46-43-40-37-34-24-21-18-15-12-9-6-3)52-59-51-48-45-42-39-36-33-31-28-26-23-20-17-14-11-8-5-2/h54H,4-53H2,1-3H3/t54-/m1/s1
InChIKeyLRKNXJCEXNBUGJ-AXAMJWTMSA-N
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606) blood plasma (BTO:0000131) MetaboLights (MTBLS2633)
Roles Classification
Biological Roles:
human metabolite  Any mammalian metabolite produced during a metabolic reaction in humans (Homo sapiens).
Saccharomyces cerevisiae metabolite  Any fungal metabolite produced during a metabolic reaction in Baker's yeast (Saccharomyces cerevisiae ).
ChEBI Ontology
Outgoing Relation(s)
TG(15:0/20:0/o-18:0) (CHEBI:172842) is a diglyceride (CHEBI:18035)
IUPAC Name 
[(2R)-1-octadecoxy-3-pentadecanoyloxypropan-2-yl] icosanoate
Manual XrefsDatabases
59652630ChemSpider
HMDB0043104HMDB