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CHEBI:29111 - α-D-GlcpNAc-(1→2)-[α-D-Manp-(1→3)]-α-D-Manp-(1→2)-α-D-Manp-(1→2)-D-Manp

Default Structure
ChEBI IDCHEBI:29111
ChEBI Nameα-D-GlcpNAc-(1→2)-[α-D-Manp-(1→3)]-α-D-Manp-(1→2)-α-D-Manp-(1→2)-D-Manp
Stars
ASCII Namealpha-D-GlcpNAc-(1->2)-[alpha-D-Manp-(1->3)]-alpha-D-Manp-(1->2)-alpha-D-Manp-(1->2)-D-Manp
DefinitionA branched amino pentasaccharide consisting of a linear chain of four α-linked D-mannose residues, with an N-acetyl glucosamine residue joined to residue 3, also via an α-linkage.
Secondary ChEBI IDsCHEBI:524, CHEBI:11163, CHEBI:18910
Last Modified7 April 2021
SubmitterMarcus Ennis
DownloadsMolfile
FormulaC32H55NO26
Net Charge0
Average Mass869.773
Monoisotopic Mass869.30123
SMILESCC(=O)N[C@H]1[C@@H](O[C@@H]2[C@@H](O[C@@H]3[C@@H](O[C@@H]4C(O)O[C@H](CO)[C@@H](O)[C@@H]4O)O[C@H](CO)[C@@H](O)[C@@H]3O)O[C@H](CO)[C@@H](O)[C@@H]2O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]2O)O[C@H](CO)[C@@H](O)[C@@H]1O
WURCSWURCS=2.0/3,5,4/[a1122h-1x_1-5][a1122h-1a_1-5][a2122h-1a_1-5_2*NCC/3=O]/1-2-2-3-2/a2-b1_b2-c1_c2-d1_c3-e1
InChIInChI=1S/C32H55NO26/c1-7(39)33-13-19(45)14(40)9(3-35)52-29(13)59-27-24(56-30-23(49)20(46)15(41)10(4-36)53-30)18(44)12(6-38)55-32(27)58-26-22(48)17(43)11(5-37)54-31(26)57-25-21(47)16(42)8(2-34)51-28(25)50/h8-32,34-38,40-50H,2-6H2,1H3,(H,33,39)/t8-,9-,10-,11-,12-,13-,14-,15-,16-,17-,18-,19-,20+,21+,22+,23+,24+,25+,26+,27+,28?,29-,30-,31-,32-/m1/s1
InChIKeyJMTBNWRTXSLTIC-IHGLRESESA-N
ChEBI Ontology
Outgoing Relation(s)
α-D-GlcpNAc-(1→2)-[α-D-Manp-(1→3)]-α-D-Manp-(1→2)-α-D-Manp-(1→2)-D-Manp (CHEBI:29111) is a (1→3)-α-D-mannooligosaccharide derivative (CHEBI:71288)
α-D-GlcpNAc-(1→2)-[α-D-Manp-(1→3)]-α-D-Manp-(1→2)-α-D-Manp-(1→2)-D-Manp (CHEBI:29111) is a amino pentasaccharide (CHEBI:59268)
α-D-GlcpNAc-(1→2)-[α-D-Manp-(1→3)]-α-D-Manp-(1→2)-α-D-Manp-(1→2)-D-Manp (CHEBI:29111) is a glucosamine oligosaccharide (CHEBI:22485)
IUPAC Name 
2-acetamido-2-deoxy-α-D-glucopyranosyl-(1→2)-[α-D-mannopyranosyl-(1→3)]-α-D-mannopyranosyl-(1→2)-α-D-mannopyranosyl-(1→2)-D-mannopyranose
Synonym  Source
1,3-alpha-D-Mannosyl-(1,2-N-acetyl-alpha-D-glucosaminyl)-1,2-alpha-D-mannosyl-1,2-alpha-D-mannosyl-D-mannoseKEGG COMPOUND
UniProt Name  Source
α-D-Man-(1→3)-[α-D-GlcNAc-(1→2)]-α-D-Man-(1→2)-α-D-Man-(1→2)-D-ManUniProt
Manual XrefsDatabases
C04923KEGG COMPOUND
C04923KEGG COMPOUND
G07376KEGG GLYCAN
G15305CQGlyGen
G15305CQGlyTouCan