CHEBI:140459 - 3-[β-D-glucopyranosyl-(1→6)-β-D-galactopyranosyl]-1,2-dimyristoyl-sn-glycerol

ChEBI IDCHEBI:140459
ChEBI Name3-[β-D-glucopyranosyl-(1→6)-β-D-galactopyranosyl]-1,2-dimyristoyl-sn-glycerol
Stars
ASCII Name3-[beta-D-glucopyranosyl-(1->6)-beta-D-galactopyranosyl]-1,2-dimyristoyl-sn-glycerol
DefinitionA 3-[β-D-glucopyranosyl-(1→6)-β-D-galactopyranosyl]-1,2-diacyl-sn-glycerol in which the acyl groups at O-1 and O-2 are both myristoyl. A synthetic acyl homologue of the β-glycolipid antigens (β-GGLs) of Mycoplasma pneumoniae.
Last Modified2 April 2018
SubmitterMarcus Ennis
DownloadsMolfile
FormulaC43H80O15
Net Charge0
Average Mass837.098
Monoisotopic Mass836.54972
SMILESCCCCCCCCCCCCCC(=O)OC[C@H](CO[C@@H]1O[C@H](CO[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H](O)[C@H](O)[C@H]1O)OC(=O)CCCCCCCCCCCCC
InChIInChI=1S/C43H80O15/c1-3-5-7-9-11-13-15-17-19-21-23-25-34(45)53-28-31(56-35(46)26-24-22-20-18-16-14-12-10-8-6-4-2)29-54-42-41(52)39(50)37(48)33(58-42)30-55-43-40(51)38(49)36(47)32(27-44)57-43/h31-33,36-44,47-52H,3-30H2,1-2H3/t31-,32-,33-,36-,37+,38+,39+,40-,41-,42-,43-/m1/s1
InChIKeyQYQXYZFJTGRFOE-CZLOFYPQSA-N
ChEBI Ontology
Outgoing Relation(s)
3-[β-D-glucopyranosyl-(1→6)-β-D-galactopyranosyl]-1,2-dimyristoyl-sn-glycerol (CHEBI:140459) is a 3-[β-D-glucopyranosyl-(1→6)-β-D-galactopyranosyl]-1,2-diacyl-sn-glycerol (CHEBI:137667)
IUPAC Name 
(2S)-3-[(6-O-β-D-glucopyranosyl-β-D-galactopyranosyl)oxy]propane-1,2-diyl ditetradecanoate
Synonyms  Source
3-O-[β-D-Glcp-(1→6)-β-D-Galp]-1,2-di-O-myristoyl-sn-glycerolChEBI
3-O-[β-D-glucopyranosyl-(1→6)-β-D-galactopyranosyl]-1,2-di-O-myristoyl-sn-glycerolIUPAC
3-[β-D-glucosyl-(1→6)-β-D-galactosyl]-1,2-dimyristoyl-sn-glycerolChEBI
3-[β-D-Glc-(1→6)-β-D-Gal]-1,2-dimyristoyl-sn-glycerolChEBI
3-O-[β-D-glucopyranosyl-(1"→6')-β-D-galactopyranosyl]-1,2-di-O-myristoyl-sn-glycerolChEBI
3-O-[β-D-Glc-(1→6)-β-D-Gal]-1,2-di-O-myristoyl-sn-glycerolChEBI
Registry NumbersSources
Reaxys:32359277Reaxys
Citations