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CHEBI:71564 - α-Neup5Ac-(2→3)-α-D-GalpNAc
| Formula | C19H32N2O14 |
| Net Charge | 0 |
| Average Mass | 512.465 |
| Monoisotopic Mass | 512.18535 |
| SMILES | [H][C@@]1([C@H](O)[C@H](O)CO)O[C@@](O[C@H]2[C@@H](O)[C@@H](CO)O[C@H](O)[C@@H]2NC(C)=O)(C(=O)O)C[C@H](O)[C@H]1NC(C)=O |
| WURCS | WURCS=2.0/2,2,1/[a2112h-1a_1-5_2*NCC/3=O][Aad21122h-2a_2-6_5*NCC/3=O]/1-2/a3-b2 |
| InChI | InChI=1S/C19H32N2O14/c1-6(24)20-11-8(26)3-19(18(31)32,34-15(11)13(28)9(27)4-22)35-16-12(21-7(2)25)17(30)33-10(5-23)14(16)29/h8-17,22-23,26-30H,3-5H2,1-2H3,(H,20,24)(H,21,25)(H,31,32)/t8-,9+,10+,11+,12+,13+,14-,15+,16+,17-,19-/m0/s1 |
| InChIKey | VTLBCLWKEJHOEE-NAFGUXDZSA-N |
| Roles Classification |
|---|
| Biological Role: | epitope The biological role played by a material entity when bound by a receptor of the adaptive immune system. Specific site on an antigen to which an antibody binds. |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| α-Neup5Ac-(2→3)-α-D-GalpNAc (CHEBI:71564) has role epitope (CHEBI:53000) |
| α-Neup5Ac-(2→3)-α-D-GalpNAc (CHEBI:71564) is a amino disaccharide (CHEBI:22480) |
| IUPAC Name |
|---|
| 5-acetamido-3,5-dideoxy-D-glycero-α-D-galacto-non-2-ulopyranonosyl-(2→3)-2-acetamido-2-deoxy-α-D-galactopyranose |
| Synonyms | Source |
|---|---|
| N-acetyl-α-neuraminyl-(2→3)-N-acetyl-α-D-galactosamine | ChEBI |
| α-Neu5Ac-(2→3)-α-D-GalNAc | ChEBI |
| Neu5Acα2-3GalNAcα | ChEBI |
| 2-acetamido-3-O-{5-acetamido-3,5-dideoxy-D-glycero-α-D-galacto-non-2-ulopyranonosyl}-2-deoxy-α-D-galactopyranose | IUPAC |
| Neu5Aca2-3GalNAca | ChEBI |
| 2-(acetylamino)-3-O-[5-(acetylamino)-3,5-dideoxy-D-glycero-α-D-galacto-2-nonulopyranonosyl]-2-deoxy-α-D-galactopyranose | ChEBI |
| Citations |
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