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CHEBI:60437 - [→2)-β-Man-(1→2)-α-Man-(1→2)-[α-Glc-(1→3)]-α-Man(1→2)-α-Man(1→3)-β-GlcNAc-(1→]2

ChEBI IDCHEBI:60437
ChEBI Name[→2)-β-Man-(1→2)-α-Man-(1→2)-[α-Glc-(1→3)]-α-Man(1→2)-α-Man(1→3)-β-GlcNAc-(1→]2
Stars
ASCII Name[->2)-beta-Man-(1->2)-alpha-Man-(1->2)-[alpha-Glc-(1->3)]-alpha-Man(1->2)-alpha-Man(1->3)-beta-GlcNAc-(1->]2
DefinitionA dodecasaccharide comprising two branched hexasaccharide units joined via a β-(1→2) linkage. Part of the lipopolysaccharide obtained from Salmonella serogroup C1.
Last Modified12 October 2010
SubmitterSteve
DownloadsMolfile
FormulaC76H128N2O61
Net Charge0
Average Mass2045.813
Monoisotopic Mass2044.69754
SMILESCC(=O)N[C@@H]1[C@@H](O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]2O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O[C@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)[C@@H]2O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]2O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]2O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O[C@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]3O[C@H]3O[C@H](CO)[C@@H](O)[C@H](O[C@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)[C@@H]3O[C@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]3O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]3O)[C@H]2NC(C)=O)[C@H](O)[C@@H](CO)O[C@H]1O
InChIInChI=1S/C76H128N2O61/c1-15(91)77-29-54(39(101)25(11-87)117-65(29)116)129-70-60(48(110)36(98)20(6-82)122-70)136-76-64(57(42(104)28(14-90)128-76)132-68-52(114)44(106)32(94)18(4-80)120-68)139-74-62(50(112)38(100)24(10-86)126-74)135-72-58(46(108)34(96)22(8-84)124-72)133-66-30(78-16(2)92)55(40(102)26(12-88)118-66)130-71-61(49(111)37(99)21(7-83)123-71)137-75-63(56(41(103)27(13-89)127-75)131-67-51(113)43(105)31(93)17(3-79)119-67)138-73-59(47(109)35(97)23(9-85)125-73)134-69-53(115)45(107)33(95)19(5-81)121-69/h17-76,79-90,93-116H,3-14H2,1-2H3,(H,77,91)(H,78,92)/t17-,18-,19-,20-,21-,22-,23-,24-,25-,26-,27-,28-,29-,30-,31-,32-,33-,34-,35-,36-,37-,38-,39-,40-,41-,42-,43+,44+,45+,46+,47+,48+,49+,50+,51-,52-,53+,54-,55-,56+,57+,58+,59+,60+,61+,62+,63+,64+,65-,66+,67-,68-,69+,70-,71-,72+,73-,74-,75-,76-/m1/s1
InChIKeySSRGLLAFPHWEDN-BXXPUQMKSA-N
Roles Classification
Biological Role:
antigen  Any substance that stimulates an immune response in the body, such as through antibody production or by presentation to a T-cell receptor after binding to a major histocompability complex (MHC).
ChEBI Ontology
Outgoing Relation(s)
[→2)-β-Man-(1→2)-α-Man-(1→2)-[α-Glc-(1→3)]-α-Man(1→2)-α-Man(1→3)-β-GlcNAc-(1→]2 (CHEBI:60437) has role antigen (CHEBI:59132)
[→2)-β-Man-(1→2)-α-Man-(1→2)-[α-Glc-(1→3)]-α-Man(1→2)-α-Man(1→3)-β-GlcNAc-(1→]2 (CHEBI:60437) is a glucosamine oligosaccharide (CHEBI:22485)
IUPAC Name 
α-D-glucopyranosyl-(1→3)-[α-D-glucopyranosyl-(1→3)-[β-D-mannopyranosyl-(1→2)-α-D-mannopyranosyl-(1→2)]-α-D-mannopyranosyl-(1→2)-α-D-mannopyranosyl-(1→3)-2-acetamido-2-deoxy-β-D-glucopyranosyl-(1→2)-β-D-mannopyranosyl-(1→2)-α-D-mannopyranosyl-(1→2)]-α-D-mannopyranosyl-(1→2)-α-D-mannopyranosyl-(1→3)-2-acetamido-2-deoxy-β-D-glucopyranose
Synonym  Source
[→2)-β-D-Man-(1→2)-α-D-Man-(1→2)-[α-D-Glc-(1→3)]-α-D-Man(1→2)-α-D-Man(1→3)-β-D-GlcNAc-(1→]2ChEBI
Citations