CHEBI:147998 - α-D-Manp-(1→3)-α-D-GlcpNAc-(1→4)-β-D-GlcpNAc

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name α-D-Manp-(1→3)-α-D-GlcpNAc-(1→4)-β-D-GlcpNAc
ChEBI ID CHEBI:147998
ChEBI ASCII Name alpha-D-Manp-(1->3)-alpha-D-GlcpNAc-(1->4)-beta-D-GlcpNAc
Definition An amino trisaccharide consisting of α-D-mannopyranose, 2-acetamido-2-deoxy-α-D-glucopyranose and 2-acetamido-2-deoxy-β-D-glucopyranose residues joined in sequence by (1→3) and (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(10(5-27)36-20(11)35)39-21-12(24-7(2)29)19(14(31)9(4-26)37-21)40-22-17(34)16(33)13(30)8(3-25)38-22/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 RDDKDHBHNMFTRT-DXLGJZRFSA-N
SMILES O([C@H]1O[C@@H]([C@@H](O)[C@H](O[C@H]2O[C@@H]([C@@H](O)[C@H](O)[C@@H]2O)CO)[C@H]1NC(=O)C)CO)[C@H]3[C@H](O)[C@@H](NC(=O)C)[C@@H](O[C@@H]3CO)O
ChEBI Ontology
Outgoing α-D-Manp-(1→3)-α-D-GlcpNAc-(1→4)-β-D-GlcpNAc (CHEBI:147998) has functional parent α-D-GlcpNAc-(1→4)-β-D-GlcpNAc (CHEBI:147136)
α-D-Manp-(1→3)-α-D-GlcpNAc-(1→4)-β-D-GlcpNAc (CHEBI:147998) has functional parent α-D-Manp-(1→3)-α-D-GlcpNAc (CHEBI:145596)
α-D-Manp-(1→3)-α-D-GlcpNAc-(1→4)-β-D-GlcpNAc (CHEBI:147998) is a acetamides (CHEBI:22160)
α-D-Manp-(1→3)-α-D-GlcpNAc-(1→4)-β-D-GlcpNAc (CHEBI:147998) is a amino trisaccharide (CHEBI:59266)
α-D-Manp-(1→3)-α-D-GlcpNAc-(1→4)-β-D-GlcpNAc (CHEBI:147998) is a glucosamine oligosaccharide (CHEBI:22485)
IUPAC Names
α-D-mannopyranosyl-(1→3)-2-acetamido-2-deoxy-α-D-glucopyranosyl-(1→4)-2-acetamido-2-deoxy-β-D-glucopyranose
Man(a1-3)GlcNAc(a1-4)b-GlcNAc
Synonyms Sources
α-D-manno-hexopyranosyl-(1→3)-2-acetamido-2-deoxy-α-D-gluco-hexopyranosyl-(1→4)-2-acetamido-2-deoxy-β-D-gluco-hexopyranose IUPAC
N-[(2R,3R,4R,5S,6R)-5-[(2R,3R,4R,5S,6R)-3-acetamido-5-hydroxy-6-(hydroxymethyl)-4-[(2S,3S,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-2,4-dihydroxy-6-(hydroxymethyl)oxan-3-yl]acetamide IUPAC
WURCS=2.0/3,3,2/[a2122h-1b_1-5_2*NCC/3=O][a2122h-1a_1-5_2*NCC/3=O][a1122h-1a_1-5]/1-2-3/a4-b1_b3-c1 SUBMITTER
Manual Xrefs Databases
G18843II GlyTouCan
G18843II GlyGen
View more database links
Last Modified
20 May 2020