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CHEBI:140667 - 6,6'-dithiodi{1-[4,6-O-[(1R)-1-carboxyethylidene]-β-D-galactosyloxy]hexane}

ChEBI IDCHEBI:140667
ChEBI Name6,6'-dithiodi{1-[4,6-O-[(1R)-1-carboxyethylidene]-β-D-galactosyloxy]hexane}
Stars
ASCII Name6,6'-dithiodi{1-[4,6-O-[(1R)-1-carboxyethylidene]-beta-D-galactosyloxy]hexane}
DefinitionAn oligosaccharide derivative consisting of two 4,6-O-[(1R)-1-carboxyethylidene]-β-D-galactosyloxy monosaccharide units linked via a dithiodihexyl divalent group. One of a panel of synthetic oligosaccharide derivatives designed to reveal a critical role of the rare aminosugar 2-acetamido-4-amino-2,4-dideoxy-D-fucose (2-acetamido-4-amino-2,4,6-trideoxy-D-galactose; D-AAT) for serotype 1 immune recognition (PMID:29632881).
Last Modified3 May 2018
SubmitterMarcus Ennis
DownloadsMolfile
FormulaC30H50O16S2
Net Charge0
Average Mass730.848
Monoisotopic Mass730.25403
SMILESC[C@@]1(C(=O)O)OC[C@H]2O[C@@H](OCCCCCCSSCCCCCCO[C@@H]3O[C@@H]4CO[C@@](C)(C(=O)O)O[C@@H]4[C@H](O)[C@H]3O)[C@H](O)[C@@H](O)[C@H]2O1
InChIInChI=1S/C30H50O16S2/c1-29(27(35)36)41-15-17-23(45-29)19(31)21(33)25(43-17)39-11-7-3-5-9-13-47-48-14-10-6-4-8-12-40-26-22(34)20(32)24-18(44-26)16-42-30(2,46-24)28(37)38/h17-26,31-34H,3-16H2,1-2H3,(H,35,36)(H,37,38)/t17-,18-,19-,20-,21-,22-,23+,24+,25-,26-,29-,30-/m1/s1
InChIKeyVJBJOIVLSBPKOT-XZCAIKBSSA-N
ChEBI Ontology
Outgoing Relation(s)
6,6'-dithiodi{1-[4,6-O-[(1R)-1-carboxyethylidene]-β-D-galactosyloxy]hexane} (CHEBI:140667) is a oligosaccharide derivative (CHEBI:63563)
6,6'-dithiodi{1-[4,6-O-[(1R)-1-carboxyethylidene]-β-D-galactosyloxy]hexane} (CHEBI:140667) is a organic disulfide (CHEBI:35489)
IUPAC Name 
6-{[6-({4,6-O-[(1R)-1-carboxyethylidene]-β-D-galactopyranosyl}oxy)hexyl]disulfanyl}hexyl 4,6-O-[(1R)-1-carboxyethylidene]-β-D-galactopyranose
Synonyms  Source
6,6'-dithiodi{1-[4,6-O-[(1R)-1-carboxyethylidene]-β-D-galactopyranosyloxy]hexane}ChEBI
6-{[6-({4,6-O-[(1R)-1-carboxyethylidene]-β-D-galactosyl}oxy)hexyl]disulfanyl}hexyl 4,6-O-[(1R)-1-carboxyethylidene]-β-D-galactoseChEBI
Citations