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CHEBI:53484 - 3-O-(N-acetyl-D-glucosaminyl)-N-acetyl-D-galactosaminitol

ChEBI IDCHEBI:53484
ChEBI Name3-O-(N-acetyl-D-glucosaminyl)-N-acetyl-D-galactosaminitol
Stars
ASCII Name3-O-(N-acetyl-D-glucosaminyl)-N-acetyl-D-galactosaminitol
DefinitionA 2-deoxy-D-glucoside consisting of N-acetyl-D-glucosamine attached to N-acetyl-D-galactosaminitol via a (1→3)-linkage.
Last Modified7 April 2021
SubmitterSteve
DownloadsMolfile
FormulaC16H30N2O11
Net Charge0
Average Mass426.419
Monoisotopic Mass426.18496
SMILESCC(=O)N[C@@H](CO)[C@@H](OC1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1NC(C)=O)[C@@H](O)[C@H](O)CO
WURCSWURCS=2.0/2,2,1/[h2112h_2*NCC/3=O][a2122h-1x_1-5_2*NCC/3=O]/1-2/a3-b1
InChIInChI=1S/C16H30N2O11/c1-6(22)17-8(3-19)15(12(25)9(24)4-20)29-16-11(18-7(2)23)14(27)13(26)10(5-21)28-16/h8-16,19-21,24-27H,3-5H2,1-2H3,(H,17,22)(H,18,23)/t8-,9+,10+,11+,12-,13+,14+,15+,16?/m0/s1
InChIKeyAKLNVEONUQARCW-NKENICJASA-N
ChEBI Ontology
Outgoing Relation(s)
3-O-(N-acetyl-D-glucosaminyl)-N-acetyl-D-galactosaminitol (CHEBI:53484) is a 2-deoxy-D-glucoside (CHEBI:19555)
Incoming Relation(s)
D-Galp-(1→4)-D-GlcpNAc-(1→3)-D-GalNAc-OH (CHEBI:147933) has functional parent 3-O-(N-acetyl-D-glucosaminyl)-N-acetyl-D-galactosaminitol (CHEBI:53484)
IUPAC Names 
2-acetamido-3-O-(2-acetamido-2-deoxy-D-glucopyranosyl)-2-deoxy-D-galactitol
2-acetamido-2-deoxy-D-glucopyranosyl-(1→3)-2-acetamido-2-deoxy-D-galactitol
Synonym  Source
HPG-Beta2-N3ChEBI
Manual XrefsDatabases
G74724PVGlyTouCan
G74724PVGlyGen
Citations