CHEBI:147248 - β-D-GlcpNAc-(1→4)-β-D-Galp-(1→4)-D-GlcpNAc

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name β-D-GlcpNAc-(1→4)-β-D-Galp-(1→4)-D-GlcpNAc
ChEBI ID CHEBI:147248
ChEBI ASCII Name beta-D-GlcpNAc-(1->4)-beta-D-Galp-(1->4)-D-GlcpNAc
Definition An amino trisaccharide consisting of 2-acetamido-2-deoxy-β-D-glucopyranose, β-D-galactopyranose and 2-acetamido-2-deoxy-D-glucopyranose residues joine in sequence by (1→4) glycosidic bonds.
Stars This entity has been manually annotated by the ChEBI Team.
Submitter Gareth Owen
Supplier Information
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Formula C22H38N2O16
Net Charge 0
Average Mass 586.544
Monoisotopic Mass 586.22213
InChI InChI=1S/C22H38N2O16/c1-6(28)23-11-15(32)18(9(4-26)36-20(11)35)40-22-17(34)16(33)19(10(5-27)38-22)39-21-12(24-7(2)29)14(31)13(30)8(3-25)37-21/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
InChIKey QKUOCJMMCKELLD-PBMFKHALSA-N
SMILES O([C@@H]1[C@H](O)[C@@H](O)[C@@H](O[C@@H]1CO)O[C@H]2[C@H](O)[C@@H](NC(=O)C)C(O[C@@H]2CO)O)[C@@H]3O[C@@H]([C@@H](O)[C@H](O)[C@H]3NC(=O)C)CO
ChEBI Ontology
Outgoing β-D-GlcpNAc-(1→4)-β-D-Galp-(1→4)-D-GlcpNAc (CHEBI:147248) has functional parent β-D-Galp-(1→4)-D-GlcpNAc (CHEBI:60152)
β-D-GlcpNAc-(1→4)-β-D-Galp-(1→4)-D-GlcpNAc (CHEBI:147248) has functional parent β-D-GlcpNAc-(1→4)-β-D-Galp (CHEBI:146619)
β-D-GlcpNAc-(1→4)-β-D-Galp-(1→4)-D-GlcpNAc (CHEBI:147248) is a acetamides (CHEBI:22160)
β-D-GlcpNAc-(1→4)-β-D-Galp-(1→4)-D-GlcpNAc (CHEBI:147248) is a amino trisaccharide (CHEBI:59266)
IUPAC Names
2-acetamido-2-deoxy-β-D-glucopyranosyl-(1→4)-β-D-galactopyranosyl-(1→4)-2-acetamido-2-deoxy-D-glucopyranose
GlcNAc(b1-4)Gal(b1-4)GlcNAc
Synonyms Sources
2-acetamido-2-deoxy-β-D-gluco-hexopyranosyl-(1→4)-β-D-galacto-hexopyranosyl-(1→4)-2-acetamido-2-deoxy-D-gluco-hexopyranose IUPAC
N-[(3R,4R,5S,6R)-5-[(2S,3R,4R,5R,6R)-5-[(2S,3R,4R,5S,6R)-3-Acetamido-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3,4-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-2,4-dihydroxy-6-(hydroxymethyl)oxan-3-yl]acetamide IUPAC
WURCS=2.0/3,3,2/[a2122h-1x_1-5_2*NCC/3=O][a2112h-1b_1-5][a2122h-1b_1-5_2*NCC/3=O]/1-2-3/a4-b1_b4-c1 SUBMITTER
Manual Xrefs Databases
G07923CD GlyTouCan
G07923CD GlyGen
G08907 KEGG GLYCAN
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Last Modified
19 May 2020