EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:169936 - β-D-GalpNAc4,6S2-(1→4)-D-GlcpNAc

ChEBI IDCHEBI:169936
ChEBI Nameβ-D-GalpNAc4,6S2-(1→4)-D-GlcpNAc
Stars
ASCII Namebeta-D-GalpNAc4,6S2-(1->4)-D-GlcpNAc
DefinitionAn amino disaccharide that consists of N-acetyl-D-glucosamine having an N-acetyl-4,6-di-O-sulfo-β-D-galactosaminyl residue attached at position 4.
Last Modified12 April 2021
SubmitterMarcus Ennis
DownloadsMolfile
FormulaC16H28N2O17S2
Net Charge0
Average Mass584.531
Monoisotopic Mass584.08294
SMILESCC(=O)N[C@H]1[C@H](O[C@H]2[C@H](O)[C@@H](NC(C)=O)C(O)O[C@@H]2CO)O[C@H](COS(=O)(=O)O)[C@H](OS(=O)(=O)O)[C@@H]1O
InChIInChI=1S/C16H28N2O17S2/c1-5(20)17-9-11(22)13(7(3-19)32-15(9)24)34-16-10(18-6(2)21)12(23)14(35-37(28,29)30)8(33-16)4-31-36(25,26)27/h7-16,19,22-24H,3-4H2,1-2H3,(H,17,20)(H,18,21)(H,25,26,27)(H,28,29,30)/t7-,8-,9-,10-,11-,12-,13-,14+,15?,16+/m1/s1
InChIKeyAWWPRNMYAMHESZ-JJYFQBDTSA-N
ChEBI Ontology
Outgoing Relation(s)
β-D-GalpNAc4,6S2-(1→4)-D-GlcpNAc (CHEBI:169936) is a amino disaccharide (CHEBI:22480)
β-D-GalpNAc4,6S2-(1→4)-D-GlcpNAc (CHEBI:169936) is a galactosamine oligosaccharide (CHEBI:22484)
β-D-GalpNAc4,6S2-(1→4)-D-GlcpNAc (CHEBI:169936) is a glucosamine oligosaccharide (CHEBI:22485)
β-D-GalpNAc4,6S2-(1→4)-D-GlcpNAc (CHEBI:169936) is a oligosaccharide sulfate (CHEBI:37909)
IUPAC Name 
2-acetamido-2-deoxy-4,6-di-O-sulfo-β-D-galactopyranosyl-(1→4)-2-acetamido-2-deoxy-D-glucopyranose
Synonyms  Source
2-acetamido-4-O-(2-acetamido-2-deoxy-4,6-di-O-sulfo-β-D-galactopyranosyl)-2-deoxy-D-glucopyranoseIUPAC
N-acetyl-4,6-di-O-sulfo-β-D-galactosaminyl-(1→4)-N-acetyl-D-glucosaminoseChEBI
GalNAc4,6S21-4GlcNAcIUPAC
(6S)(4S)GalNAcb1-4GlcNAcChEBI
Citations