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CHEBI:147876 - 2-acetamido-2-deoxy-α-D-Galp-(1→3)-2-acetamido-2-deoxy-D-Gal-OH

ChEBI IDCHEBI:147876
ChEBI Name2-acetamido-2-deoxy-α-D-Galp-(1→3)-2-acetamido-2-deoxy-D-Gal-OH
Stars
ASCII Name2-acetamido-2-deoxy-alpha-D-Galp-(1->3)-2-acetamido-2-deoxy-D-Gal-OH
DefinitionA glycosyl alditol derivative that is N-acetyl-D-galactosaminitol in which the hydroxy group at position 3 has been converted into the corresponding 2-acetamido-2-deoxy-α-D-galactopyranosyl derivative.
Last Modified4 May 2020
SubmitterGareth Owen
DownloadsMolfile
FormulaC16H30N2O11
Net Charge0
Average Mass426.419
Monoisotopic Mass426.18496
SMILESCC(=O)N[C@H]1[C@@H](O[C@@H]([C@@H](O)[C@H](O)CO)[C@H](CO)NC(C)=O)O[C@H](CO)[C@H](O)[C@@H]1O
WURCSWURCS=2.0/2,2,1/[h2112h_2*NCC/3=O][a2112h-1a_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-VRBIDZHXSA-N
ChEBI Ontology
Outgoing Relation(s)
2-acetamido-2-deoxy-α-D-Galp-(1→3)-2-acetamido-2-deoxy-D-Gal-OH (CHEBI:147876) has functional parent N-acetyl-D-galactosaminitol (CHEBI:53480)
2-acetamido-2-deoxy-α-D-Galp-(1→3)-2-acetamido-2-deoxy-D-Gal-OH (CHEBI:147876) has functional parent N-acetyl-α-D-galactosamine (CHEBI:40356)
2-acetamido-2-deoxy-α-D-Galp-(1→3)-2-acetamido-2-deoxy-D-Gal-OH (CHEBI:147876) is a glycosyl alditol derivative (CHEBI:63424)
IUPAC Name 
2-acetamido-3-O-(2-acetamido-2-deoxy-α-D-galactopyranosyl)-2-deoxy-D-galactitol
Synonym  Source
N-[(2S,3R,4R,5R,6R)-2-[(2S,3R,4S,5R)-2-acetamido-1,4,5,6-tetrahydroxyhexan-3-yl]oxy-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl]acetamideIUPAC
Manual XrefsDatabases
G15144TIGlyTouCan
G15144TIGlyGen