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CHEBI:146494 - β-D-GlcpNAc-(1→2)-β-D-Manp-(1→2)-β-D-Manp-(1→4)-β-D-Glcp

ChEBI IDCHEBI:146494
ChEBI Nameβ-D-GlcpNAc-(1→2)-β-D-Manp-(1→2)-β-D-Manp-(1→4)-β-D-Glcp
Stars
ASCII Namebeta-D-GlcpNAc-(1->2)-beta-D-Manp-(1->2)-beta-D-Manp-(1->4)-beta-D-Glcp
DefinitionAn amino tetrasaccharide consisting of a 2-acetamido-2-deoxy-β-D-glucopyranose residue, two β-D-mannopyranose residues and a β-D-glucopyranose residue joined in sequence by (1→2), (1→2), and (1→4) glycosidic bonds.
Last Modified8 September 2020
SubmitterGareth Owen
DownloadsMolfile
FormulaC26H45NO21
Net Charge0
Average Mass707.632
Monoisotopic Mass707.24841
SMILESCC(=O)N[C@H]1[C@H](O[C@@H]2[C@H](O[C@@H]3[C@H](O[C@H]4[C@H](O)[C@@H](O)[C@H](O)O[C@@H]4CO)O[C@H](CO)[C@@H](O)[C@@H]3O)O[C@H](CO)[C@@H](O)[C@@H]2O)O[C@H](CO)[C@@H](O)[C@@H]1O
WURCSWURCS=2.0/3,4,3/[a2122h-1b_1-5][a1122h-1b_1-5][a2122h-1b_1-5_2*NCC/3=O]/1-2-2-3/a4-b1_b2-c1_c2-d1
InChIInChI=1S/C26H45NO21/c1-6(32)27-11-15(36)12(33)7(2-28)43-24(11)47-21-16(37)13(34)9(4-30)45-26(21)48-22-17(38)14(35)8(3-29)44-25(22)46-20-10(5-31)42-23(41)19(40)18(20)39/h7-26,28-31,33-41H,2-5H2,1H3,(H,27,32)/t7-,8-,9-,10-,11-,12-,13-,14-,15-,16+,17+,18-,19-,20-,21+,22+,23-,24+,25+,26+/m1/s1
InChIKeyMGITWNQXRFBXEJ-ZIGPYHIDSA-N
ChEBI Ontology
Outgoing Relation(s)
β-D-GlcpNAc-(1→2)-β-D-Manp-(1→2)-β-D-Manp-(1→4)-β-D-Glcp (CHEBI:146494) is a acetamides (CHEBI:22160)
β-D-GlcpNAc-(1→2)-β-D-Manp-(1→2)-β-D-Manp-(1→4)-β-D-Glcp (CHEBI:146494) is a amino tetrasaccharide (CHEBI:59412)
IUPAC Names 
GlcNAc(b1-2)Man(b1-2)Man(b1-4)b-Glc
2-acetamido-2-deoxy-β-D-glucopyranosyl-(1→2)-β-D-mannopyranosyl-(1→2)-β-D-mannopyranosyl-(1→4)-β-D-glucopyranose
Synonyms  Source
2-acetamido-2-deoxy-β-D-gluco-hexopyranosyl-(1→2)-β-D-manno-hexopyranosyl-(1→2)-β-D-manno-hexopyranosyl-(1→4)-β-D-gluco-hexopyranoseIUPAC
N-[(2S,3R,4R,5S,6R)-2-[(2S,3S,4S,5S,6R)-2-[(2S,3S,4S,5S,6R)-4,5-dihydroxy-6-(hydroxymethyl)-2-[(2R,3S,4R,5R,6R)-4,5,6-trihydroxy-2-(hydroxymethyl)oxan-3-yl]oxyoxan-3-yl]oxy-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl]oxy-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl]acetamideIUPAC
Manual XrefsDatabases
G03081THGlyTouCan
G03081THGlyGen