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CHEBI:191331 - 18:0-16:1-MGDG

ChEBI IDCHEBI:191331
ChEBI Name18:0-16:1-MGDG
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC43H80O10
Net Charge0
Average Mass757.103
Monoisotopic Mass756.57515
SMILESCCCCCCCC/C=C\CCCCCC(=O)O[C@H](COC(=O)CCCCCCCCCCCCCCCCC)CO[C@@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1O
InChIInChI=1S/C43H80O10/c1-3-5-7-9-11-13-15-17-18-20-21-23-25-27-29-31-38(45)50-34-36(35-51-43-42(49)41(48)40(47)37(33-44)53-43)52-39(46)32-30-28-26-24-22-19-16-14-12-10-8-6-4-2/h19,22,36-37,40-44,47-49H,3-18,20-21,23-35H2,1-2H3/b22-19-/t36-,37-,40+,41+,42-,43-/m1/s1
InChIKeyHGXOEZRIOVHLNF-CINMOFIISA-N
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606) hTERT-RPE1 cell (BTO:0004790) MetaboLights (MTBLS682)
Roles Classification
Biological Role:
mouse metabolite  Any mammalian metabolite produced during a metabolic reaction in a mouse (Mus musculus).
ChEBI Ontology
Outgoing Relation(s)
18:0-16:1-MGDG (CHEBI:191331) is a 1,2-diacyl-3-β-D-galactosyl-sn-glycerol (CHEBI:17615)
IUPAC Name 
[(2S)-2-[(Z)-hexadec-7-enoyl]oxy-3-[(2R,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxypropyl] octadecanoate
Manual XrefsDatabases
58837173ChemSpider