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Substance Name: Streptococcal polysaccharide Ia group B
RN: 84280-28-4
InChIKey: JTFSWAXKFBZNJE-IXANPYFWSA-N

Molecular Formula

  • C37-H62-N2-O29

Molecular Weight

  • 998.882
 
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Names and Synonyms

Name of Substance

  • Streptococcal polysaccharide Ia group B

Synonyms

  • Polysaccharide type Ia group B, streptococcal
  • Strep polysaccharide B Ia

Systematic Name

  • beta-D-Galactopyranose, O-(N-acetyl-alpha-neuraminosyl)-(2-3)-O-beta-D-galactopyranosyl-(1-4)-O-2-(acetylamino)-2-deoxy-beta-D-glucopyranosyl-(1-3)-O-(beta-D-glucopyranosyl-(1-4))-

Registry Numbers

CAS Registry Number

  • 84280-28-4

System Generated Number

  • 0084280284

Structure Descriptors

InChI

1S/C37H62N2O29/c1-9(45)38-17-11(47)3-37(36(58)59,67-29(17)19(49)12(48)4-40)68-30-21(51)14(6-42)62-35(26(30)56)64-27-15(7-43)63-33(18(22(27)52)39-10(2)46)66-31-25(55)32(57)60-16(8-44)28(31)65-34-24(54)23(53)20(50)13(5-41)61-34/h11-35,40-44,47-57H,3-8H2,1-2H3,(H,38,45)(H,39,46)(H,58,59)/t11-,12+,13+,14+,15+,16+,17+,18+,19+,20+,21-,22+,23-,24+,25+,26+,27+,28-,29+,30-,31+,32+,33-,34-,35-,37-/m0/s1

InChIKey

JTFSWAXKFBZNJE-IXANPYFWSA-N

Smiles

C1[C@@](O[C@@H]([C@@H]([C@@H](CO)O)O)[C@@H]([C@H]1O)NC(C)=O)(C(O)=O)O[C@H]1[C@H]([C@H](O[C@H]([C@@H]1O)O[C@@H]1[C@@H](CO)O[C@H]([C@@H]([C@H]1O)NC(C)=O)O[C@H]1[C@@H](O[C@H]2[C@H](O)[C@@H](O)[C@H](O)[C@H](CO)O2)[C@H](O[C@H](O)[C@@H]1O)CO)CO)O