EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:152179 - D-GlcpNAc-(1→3)-D-GalpNAc

ChEBI IDCHEBI:152179
ChEBI NameD-GlcpNAc-(1→3)-D-GalpNAc
Stars
ASCII NameD-GlcpNAc-(1->3)-D-GalpNAc
DefinitionAn amino disaccharide consisting of 2-acetamido-2-deoxy-D-glucopyranose and 2-acetamido-2-deoxy-D-galactopyranose joined in sequence by a (1→3) glycosidic bond.
Last Modified14 October 2020
SubmitterGareth Owen
DownloadsMolfile
FormulaC16H28N2O11
Net Charge0
Average Mass424.403
Monoisotopic Mass424.16931
SMILESCC(=O)N[C@H]1C(O[C@H]2[C@@H](O)[C@@H](CO)OC(O)[C@@H]2NC(C)=O)O[C@H](CO)[C@@H](O)[C@@H]1O
WURCSWURCS=2.0/2,2,1/[a2112h-1x_1-5_2*NCC/3=O][a2122h-1x_1-5_2*NCC/3=O]/1-2/a3-b1
InChIInChI=1S/C16H28N2O11/c1-5(21)17-9-13(25)11(23)7(3-19)28-16(9)29-14-10(18-6(2)22)15(26)27-8(4-20)12(14)24/h7-16,19-20,23-26H,3-4H2,1-2H3,(H,17,21)(H,18,22)/t7-,8-,9-,10-,11-,12+,13-,14-,15?,16?/m1/s1
InChIKeyFJGXDMQHNYEUHI-GXBDPHQQSA-N
ChEBI Ontology
Outgoing Relation(s)
D-GlcpNAc-(1→3)-D-GalpNAc (CHEBI:152179) is a acetamides (CHEBI:22160)
D-GlcpNAc-(1→3)-D-GalpNAc (CHEBI:152179) is a amino disaccharide (CHEBI:22480)
D-GlcpNAc-(1→3)-D-GalpNAc (CHEBI:152179) is a galactosamine oligosaccharide (CHEBI:22484)
D-GlcpNAc-(1→3)-D-GalpNAc (CHEBI:152179) is a partially-defined glycan (CHEBI:146306)
IUPAC Names 
GlcNAc(?1-3)GalNAc
2-acetamido-3-O-(2-acetamido-2-deoxy-D-glucopyranosyl)-2-deoxy-D-galactopyranose
Synonyms  Source
2-acetamido-2-deoxy-D-galacto-hexopyranosyl-(1→3)-2-acetamido-2-deoxy-D-galacto-hexopyranoseIUPAC
N-[(3R,4R,5R,6R)-2-{[(3R,4R,5R,6R)-3-acetamido-2,5-dihydroxy-6-(hydroxymethyl)oxan-4-yl]oxy}-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl]acetamideIUPAC
Manual XrefsDatabases
G60564JXGlyTouCan
G60564JXGlyGen