CHEBI:140460 - 3-[β-D-glucopyranosyl-(1→6)-β-D-galactopyranosyl]-1,2-dipalmitoyl-sn-glycerol

ChEBI IDCHEBI:140460
ChEBI Name3-[β-D-glucopyranosyl-(1→6)-β-D-galactopyranosyl]-1,2-dipalmitoyl-sn-glycerol
Stars
ASCII Name3-[beta-D-glucopyranosyl-(1->6)-beta-D-galactopyranosyl]-1,2-dipalmitoyl-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 palmitoyl. A synthetic acyl homologue of the β-glycolipid antigens (β-GGLs) of Mycoplasma pneumoniae.
Last Modified2 April 2018
SubmitterMarcus Ennis
DownloadsMolfile
FormulaC47H88O15
Net Charge0
Average Mass893.206
Monoisotopic Mass892.61232
SMILESCCCCCCCCCCCCCCCC(=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)CCCCCCCCCCCCCCC
InChIInChI=1S/C47H88O15/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-38(49)57-32-35(60-39(50)30-28-26-24-22-20-18-16-14-12-10-8-6-4-2)33-58-46-45(56)43(54)41(52)37(62-46)34-59-47-44(55)42(53)40(51)36(31-48)61-47/h35-37,40-48,51-56H,3-34H2,1-2H3/t35-,36-,37-,40-,41+,42+,43+,44-,45-,46-,47-/m1/s1
InChIKeyTUUXXJDESDKYDH-GFBMXRCWSA-N
ChEBI Ontology
Outgoing Relation(s)
3-[β-D-glucopyranosyl-(1→6)-β-D-galactopyranosyl]-1,2-dipalmitoyl-sn-glycerol (CHEBI:140460) 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 dihexadecanoate
Synonyms  Source
3-O-[β-D-glucopyranosyl-(1"→6')-β-D-galactopyranosyl]-1,2-di-O-palmitoyl-sn-glycerolChEBI
3-[β-D-Glcp-(1→6)-β-D-Galp]-1,2-dipalmitoyl-sn-glycerolChEBI
3-[β-D-glucosyl-(1→6)-β-D-galactosyl]-1,2-dipalmitoyl-sn-glycerolChEBI
3-O-[β-D-glucopyranosyl-(1→6)-β-D-galactopyranosyl]-1,2-di-O-hexadecanoyl-sn-glycerolIUPAC
βGGL-C16ChEBI
3-O-[β-D-glucopyranosyl-(1→6)-β-D-galactopyranosyl]-1,2-di-O-palmitoyl-sn-glycerolChEBI
Registry NumbersSources
Reaxys:21142982Reaxys
Citations