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CHEBI:191308 - DG(19:0/22:2(13Z,16Z)/0:0)[iso2]

ChEBI IDCHEBI:191308
ChEBI NameDG(19:0/22:2(13Z,16Z)/0:0)[iso2]
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC44H82O5
Net Charge0
Average Mass691.135
Monoisotopic Mass690.61623
SMILESCCCCC/C=C\C/C=C\CCCCCCCCCCCC(=O)O[C@@H](CO)COC(=O)CCCCCCCCCCCCCCCCCC
InChIInChI=1S/C44H82O5/c1-3-5-7-9-11-13-15-17-19-21-22-23-25-27-29-31-33-35-37-39-44(47)49-42(40-45)41-48-43(46)38-36-34-32-30-28-26-24-20-18-16-14-12-10-8-6-4-2/h11,13,17,19,42,45H,3-10,12,14-16,18,20-41H2,1-2H3/b13-11-,19-17-/t42-/m0/s1
InChIKeyBMYCNFXFEYALSP-WEZQMRNCSA-N
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606) hTERT-RPE1 cell (BTO:0004790) MetaboLights (MTBLS682)
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)
DG(19:0/22:2(13Z,16Z)/0:0)[iso2] (CHEBI:191308) is a 1,2-diglyceride (CHEBI:49172)
IUPAC Name 
[(2S)-1-hydroxy-3-nonadecanoyloxypropan-2-yl] (13Z,16Z)-docosa-13,16-dienoate
Manual XrefsDatabases
7822837ChemSpider
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