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CHEBI:53485 - N-acetyl-D-galactosaminyl-(1→4)-(N-acetyl-D-galactosaminyl)-(1→3)-N-acetyl-D-galactosaminitol

ChEBI IDCHEBI:53485
ChEBI NameN-acetyl-D-galactosaminyl-(1→4)-(N-acetyl-D-galactosaminyl)-(1→3)-N-acetyl-D-galactosaminitol
Stars
ASCII NameN-acetyl-D-galactosaminyl-(1->4)-(N-acetyl-D-galactosaminyl)-(1->3)-N-acetyl-D-galactosaminitol
DefinitionAn amino disaccharide compound consisting of N-acetyl-D-galactosaminyl-(1→4)-N-acetyl-D-galactosamine attached to N-acetyl-D-galactosaminitol via a (1→3)-linkage.
Last Modified13 June 2013
SubmitterSteve
DownloadsMolfile
FormulaC24H43N3O16
Net Charge0
Average Mass629.613
Monoisotopic Mass629.26433
SMILESCC(=O)N[C@@H](CO)[C@@H](OC1O[C@H](CO)[C@@H](OC2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2NC(C)=O)[C@H](O)[C@H]1NC(C)=O)[C@@H](O)[C@H](O)CO
InChIInChI=1S/C24H43N3O16/c1-8(32)25-11(4-28)21(17(36)12(35)5-29)42-24-16(27-10(3)34)20(39)22(14(7-31)41-24)43-23-15(26-9(2)33)19(38)18(37)13(6-30)40-23/h11-24,28-31,35-39H,4-7H2,1-3H3,(H,25,32)(H,26,33)(H,27,34)/t11-,12+,13+,14+,15+,16+,17-,18-,19+,20+,21+,22+,23?,24?/m0/s1
InChIKeyXKCFKZFWLHKQKE-PHRIDPEQSA-N
ChEBI Ontology
Outgoing Relation(s)
N-acetyl-D-galactosaminyl-(1→4)-(N-acetyl-D-galactosaminyl)-(1→3)-N-acetyl-D-galactosaminitol (CHEBI:53485) is a amino disaccharide (CHEBI:22480)
IUPAC Name 
2-acetamido-2-deoxy-D-galactopyranosyl-(1→4)-2-acetamido-2-deoxy-D-glucopyranosyl-(1→3)-2-acetamido-2-deoxy-D-galactitol
Synonyms  Source
HPG-Beta2-N4aChEBI
D-GalNAc-(1→4)-D-GlcNAc-(1→3)-D-GalNAc-olChEBI
D-GalpNAc-(1→4)-D-GlcpNAc-(1→3)-D-GalNAc-olJCBN
Citations