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CHEBI:63014 - α-D-Galp-(1→4)-β-D-Galp-(1→4)-β-D-Glcp-O(CH2)2S(CH2)2CO2Me

ChEBI IDCHEBI:63014
ChEBI Nameα-D-Galp-(1→4)-β-D-Galp-(1→4)-β-D-Glcp-O(CH2)2S(CH2)2CO2Me
Stars
ASCII Namealpha-D-Galp-(1->4)-beta-D-Galp-(1->4)-beta-D-Glcp-O(CH2)2S(CH2)2CO2Me
DefinitionA glycoside that consists of α-D-galactosyl-(1→4)-β-D-galactosyl-(1→4)-β-D-glucose having a 2-(2-methoxycarbonylethylthio)ethyl (CETE) moiety attached to the reducing end anomeric centre.
Last Modified6 March 2015
SubmitterSteve
DownloadsMolfile
FormulaC24H42O18S
Net Charge0
Average Mass650.649
Monoisotopic Mass650.20919
SMILESCOC(=O)CCSCCO[C@@H]1O[C@H](CO)[C@@H](O[C@@H]2O[C@H](CO)[C@H](O[C@H]3O[C@H](CO)[C@H](O)[C@H](O)[C@H]3O)[C@H](O)[C@H]2O)[C@H](O)[C@H]1O
InChIInChI=1S/C24H42O18S/c1-36-12(28)2-4-43-5-3-37-22-18(34)15(31)20(10(7-26)39-22)42-24-19(35)16(32)21(11(8-27)40-24)41-23-17(33)14(30)13(29)9(6-25)38-23/h9-11,13-27,29-35H,2-8H2,1H3/t9-,10-,11-,13+,14+,15-,16-,17-,18-,19-,20-,21+,22-,23-,24+/m1/s1
InChIKeyYCLNBODFVZWIDY-HZUJBJQYSA-N
ChEBI Ontology
Outgoing Relation(s)
α-D-Galp-(1→4)-β-D-Galp-(1→4)-β-D-Glcp-O(CH2)2S(CH2)2CO2Me (CHEBI:63014) is a aliphatic sulfide (CHEBI:22327)
α-D-Galp-(1→4)-β-D-Galp-(1→4)-β-D-Glcp-O(CH2)2S(CH2)2CO2Me (CHEBI:63014) is a carbohydrate acid ester (CHEBI:37696)
α-D-Galp-(1→4)-β-D-Galp-(1→4)-β-D-Glcp-O(CH2)2S(CH2)2CO2Me (CHEBI:63014) is a glycoside (CHEBI:24400)
α-D-Galp-(1→4)-β-D-Galp-(1→4)-β-D-Glcp-O(CH2)2S(CH2)2CO2Me (CHEBI:63014) is a methyl ester (CHEBI:25248)
α-D-Galp-(1→4)-β-D-Galp-(1→4)-β-D-Glcp-O(CH2)2S(CH2)2CO2Me (CHEBI:63014) is a trisaccharide derivative (CHEBI:63571)
IUPAC Name 
methyl 3-[(2-{[α-D-galactopyranosyl-(1→4)-β-D-galactopyranosyl-(1→4)-β-D-glucopyranosyl]oxy}ethyl)sulfanyl]propanoate
Synonyms  Source
α-D-Gal-(1→4)-β-D-Gal-(1→4)-β-D-Glc-O(CH2)2S(CH2)2CO2MeChEBI
α-D-Galp-(1→4)-β-D-Galp-(1→4)-β-D-Glcp-O-CETEChEBI
α-D-Gal-(1→4)-β-D-Gal-(1→4)-β-D-Glc-O-CETEChEBI
Galα1-4Galβ1-4Glcβ-O-CETEChEBI
methyl 3-[(2-{[α-D-galactosyl-(1→4)-β-D-galactosyl-(1→4)-β-D-glucosyl]oxy}ethyl)sulfanyl]propanoateChEBI
2-(2-methoxycarbonylethylthio)ethyl α-D-galactopyranosyl-(1→4)-β-D-galactopyranosyl-(1→4)-β-D-glucopyranosideChEBI
Registry NumbersSources
Reaxys:5692077Reaxys
Citations