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CHEBI:140458 - 3-[β-D-glucopyranosyl-(1→6)-β-D-galactopyranosyl]-1,2-dilauroyl-sn-glycerol

ChEBI IDCHEBI:140458
ChEBI Name3-[β-D-glucopyranosyl-(1→6)-β-D-galactopyranosyl]-1,2-dilauroyl-sn-glycerol
Stars
ASCII Name3-[beta-D-glucopyranosyl-(1->6)-beta-D-galactopyranosyl]-1,2-dilauroyl-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 lauroyl. A synthetic acyl homologue of the β-glycolipid antigens (β-GGLs) of Mycoplasma pneumoniae.
Last Modified2 April 2018
SubmitterMarcus Ennis
DownloadsMolfile
FormulaC39H72O15
Net Charge0
Average Mass780.990
Monoisotopic Mass780.48712
SMILESCCCCCCCCCCCC(=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)CCCCCCCCCCC
InChIInChI=1S/C39H72O15/c1-3-5-7-9-11-13-15-17-19-21-30(41)49-24-27(52-31(42)22-20-18-16-14-12-10-8-6-4-2)25-50-38-37(48)35(46)33(44)29(54-38)26-51-39-36(47)34(45)32(43)28(23-40)53-39/h27-29,32-40,43-48H,3-26H2,1-2H3/t27-,28-,29-,32-,33+,34+,35+,36-,37-,38-,39-/m1/s1
InChIKeyFYXYTEZUINAIJQ-LTUHVBRHSA-N
ChEBI Ontology
Outgoing Relation(s)
3-[β-D-glucopyranosyl-(1→6)-β-D-galactopyranosyl]-1,2-dilauroyl-sn-glycerol (CHEBI:140458) 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 didodecanoate
Synonyms  Source
3-O-[β-D-glucopyranosyl-(1→6)-β-D-galactopyranosyl]-1,2-di-O-lauroyl-sn-glycerolChEBI
3-O-[β-D-glucopyranosyl-(1→6)-β-D-galactopyranosyl]-1,2-di-O-dodecanoyl-sn-glycerolIUPAC
3-O-[β-D-Glcp-(1→6)-β-D-Galp]-1,2-di-O-lauroyl-sn-glycerolChEBI
3-[β-D-Glc-(1→6)-β-D-Gal]-1,2-dilauroyl-sn-glycerolChEBI
3-[β-D-glucosyl-(1→6)-β-D-galactosyl]-1,2-dilauroyl-sn-glycerolChEBI
3-O-[β-D-Glc-(1→6)-β-D-Gal]-1,2-di-O-lauroyl-sn-glycerolChEBI
Registry NumbersSources
Reaxys:32359275Reaxys
Citations