EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:61044 - 2-acetamido-2-deoxy-3-O-(6-O-sulfo-β-D-glucosyl)-β-D-galactose

ChEBI IDCHEBI:61044
ChEBI Name2-acetamido-2-deoxy-3-O-(6-O-sulfo-β-D-glucosyl)-β-D-galactose
Stars
ASCII Name2-acetamido-2-deoxy-3-O-(6-O-sulfo-beta-D-glucosyl)-beta-D-galactose
DefinitionAn amino disaccharide consisting of N-acetyl-β-D-galactosamine having a 6-O-sulfo-β-D-glucosyl residue attached at the 3-position.
Last Modified18 January 2011
SubmitterSteve
DownloadsMolfile
FormulaC14H25NO14S
Net Charge0
Average Mass463.414
Monoisotopic Mass463.09958
SMILESCC(=O)N[C@@H]1[C@@H](O[C@@H]2O[C@H](COS(=O)(=O)O)[C@@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@@H](CO)O[C@H]1O
InChIInChI=1S/C14H25NO14S/c1-4(17)15-7-12(9(19)5(2-16)27-13(7)22)29-14-11(21)10(20)8(18)6(28-14)3-26-30(23,24)25/h5-14,16,18-22H,2-3H2,1H3,(H,15,17)(H,23,24,25)/t5-,6-,7-,8-,9+,10+,11-,12-,13-,14+/m1/s1
InChIKeyZSSIKYJYLIRCAK-UHDFQWBXSA-N
ChEBI Ontology
Outgoing Relation(s)
2-acetamido-2-deoxy-3-O-(6-O-sulfo-β-D-glucosyl)-β-D-galactose (CHEBI:61044) is a amino disaccharide (CHEBI:22480)
2-acetamido-2-deoxy-3-O-(6-O-sulfo-β-D-glucosyl)-β-D-galactose (CHEBI:61044) is a oligosaccharide sulfate (CHEBI:37909)
2-acetamido-2-deoxy-3-O-(6-O-sulfo-β-D-glucosyl)-β-D-galactose (CHEBI:61044) is conjugate acid of 2-acetamido-2-deoxy-3-O-(6-O-sulfonato-β-D-glucosyl)-β-D-galactose (CHEBI:61041)
Incoming Relation(s)
2-acetamido-2-deoxy-3-O-(6-O-sulfonato-β-D-glucosyl)-β-D-galactose (CHEBI:61041) is conjugate base of 2-acetamido-2-deoxy-3-O-(6-O-sulfo-β-D-glucosyl)-β-D-galactose (CHEBI:61044)
IUPAC Name 
6-O-sulfo-β-D-glucopyranosyl-(1→3)-2-acetamido-2-deoxy-β-D-galactopyranose
Synonym  Source
2-acetamido-2-deoxy-3-O-(6-O-sulfo-β-D-glucopyranosyl)-β-D-galactopyranoseIUPAC