EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | (C43H70N2O33)n.H2O |
| Net Charge | 0 |
| Average Mass | 1161.029 |
| Monoisotopic Mass | 1160.39665 |
| SMILES | [H]OC[C@H]1O[C@@H](O[C@H]2[C@@H](O)[C@@H](CO)O[C@@H](O[C@H]3[C@H](O)[C@@H](O)[C@H](O)O[C@@H]3CO)[C@@H]2O)[C@H](O)[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O[C@@H]3O[C@H](CO[C@]4(C(=O)O)C[C@H](O)[C@@H](NC(C)=O)[C@]([H])([C@H](O)[C@H](O)CO)O4)[C@H](O)[C@H](O)[C@H]3O)[C@H](O)[C@H]2NC(C)=O)[C@H]1O |
| InChI | InChI=1S/C43H72N2O34/c1-10(51)44-19-12(53)3-43(42(67)68,79-34(19)21(55)13(54)4-46)69-9-18-22(56)26(60)29(63)39(74-18)75-32-17(8-50)73-38(20(25(32)59)45-11(2)52)77-35-23(57)14(5-47)72-41(30(35)64)78-36-24(58)15(6-48)71-40(31(36)65)76-33-16(7-49)70-37(66)28(62)27(33)61/h12-41,46-50,53-66H,3-9H2,1-2H3,(H,44,51)(H,45,52)(H,67,68)/t12-,13+,14+,15+,16+,17+,18+,19+,20+,21+,22-,23-,24-,25+,26-,27+,28+,29+,30+,31+,32+,33+,34+,35-,36-,37+,38-,39-,40-,41-,43+/m0/s1 |
| InChIKey | ICGPUNGYEQBPKT-OAVFGZILSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| [6)-[α-Neup5Ac-(2→6)-β-D-Galp-(1→4)-β-D-GlcpNAc-(1→3)]-β-D-Galp-(1→3)-β-D-Galp-(1→4)-β-D-Glcp-(1→]n (CHEBI:131940) is a polysaccharide derivative (CHEBI:65212) |
| IUPAC Name |
|---|
| [6)-[α-Neup5Ac-(2→6)-β-D-Galp-(1→4)-β-D-GlcpNAc-(1→3)]-β-D-Galp-(1→3)-β-D-Galp-(1→4)-β-D-Glcp-(1→]n |
| Synonyms | Source |
|---|---|
| [6)-[N-acetyl-α-neuraminyl-(2→6)-β-D-galactosyl-(1→4)-N-acetyl-β-D-glucosaminyl-(1→3)]-β-D-galactosyl-(1→3)-β-D-galactosyl-(1→4)-β-D-glucosyl-(1→]n | ChEBI |
| S. suis serotype 14 capsular polysaccharide | ChEBI |
| [6)-[α-Neu5Ac-(2→6)-β-D-Gal-(1→4)-β-D-GlcNAc-(1→3)]-β-D-Gal-(1→3)-β-D-Gal-(1→4)-β-D-Glc-(1→]n | ChEBI |
| Streptococcus suis serotype 14 capsular polysaccharide | ChEBI |
| [6)[Neu5Ac(α2-6)Gal(β1-4)GlcNAc(β1-3)]Gal(β1-3)Gal(β1-4)Glc(β1-]n | ChEBI |
| Citations |
|---|