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CHEBI:146838 - β-D-GlcpNAc-(1→4)-β-D-GlcpNAc-(1→2)-D-Galp

ChEBI IDCHEBI:146838
ChEBI Nameβ-D-GlcpNAc-(1→4)-β-D-GlcpNAc-(1→2)-D-Galp
Stars
ASCII Namebeta-D-GlcpNAc-(1->4)-beta-D-GlcpNAc-(1->2)-D-Galp
DefinitionAn amino trisaccharide consisting of two 2-acetamido-2-deoxy-β-D-glucopyranose residues and a D-galactopyranose residue joined in sequence by (1→4) and (1→2) glycosidic linkages.
Last Modified21 April 2020
SubmitterGareth Owen
DownloadsMolfile
FormulaC22H38N2O16
Net Charge0
Average Mass586.544
Monoisotopic Mass586.22213
SMILESCC(=O)N[C@H]1[C@H](O[C@H]2C(O)O[C@H](CO)[C@H](O)[C@@H]2O)O[C@H](CO)[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2NC(C)=O)[C@@H]1O
WURCSWURCS=2.0/2,3,2/[a2112h-1x_1-5][a2122h-1b_1-5_2*NCC/3=O]/1-2-2/a2-b1_b4-c1
InChIInChI=1S/C22H38N2O16/c1-6(28)23-11-15(32)13(30)9(4-26)37-21(11)39-18-10(5-27)38-22(12(16(18)33)24-7(2)29)40-19-17(34)14(31)8(3-25)36-20(19)35/h8-22,25-27,30-35H,3-5H2,1-2H3,(H,23,28)(H,24,29)/t8-,9-,10-,11-,12-,13-,14+,15-,16-,17+,18-,19-,20?,21+,22+/m1/s1
InChIKeyUYGRYXWJTJIXNK-FOBDTGOYSA-N
ChEBI Ontology
Outgoing Relation(s)
β-D-GlcpNAc-(1→4)-β-D-GlcpNAc-(1→2)-D-Galp (CHEBI:146838) is a acetamides (CHEBI:22160)
β-D-GlcpNAc-(1→4)-β-D-GlcpNAc-(1→2)-D-Galp (CHEBI:146838) is a amino trisaccharide (CHEBI:59266)
IUPAC Names 
GlcNAc(b1-4)GlcNAc(b1-2)Gal
2-acetamido-2-deoxy-β-D-glucopyranosyl-(1→4)-2-acetamido-2-deoxy-β-D-glucopyranosyl-(1→2)-D-galactopyranose
Synonyms  Source
2-acetamido-2-deoxy-β-D-gluco-hexopyranosyl-(1→4)-2-acetamido-2-deoxy-β-D-gluco-hexopyranosyl-(1→2)-D-galacto-hexopyranoseIUPAC
N-[(2S,3R,4R,5S,6R)-2-[(2R,3S,4R,5R,6S)-5-acetamido-4-hydroxy-2-(hydroxymethyl)-6-[(3R,4S,5R,6R)-2,4,5-trihydroxy-6-(hydroxymethyl)oxan-3-yl]oxyoxan-3-yl]oxy-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl]acetamideIUPAC
Manual XrefsDatabases
G05581UWGlyTouCan
G09048KEGG GLYCAN
G05581UWGlyGen