Z3Q
Summary
| Name: | 2-azidoethyl 2-acetamido-2-deoxy-beta-D-glucopyranoside |
| Synonyms: | 2-azidoethyl 2-(acetylamino)-2-deoxy-beta-D-glucopyranoside 2-azidoethyl 2-acetamido-2-deoxy-beta-D-glucoside; 2-azidoethyl 2-acetamido-2-deoxy-D-glucoside; 2-azidoethyl 2-acetamido-2-deoxy-glucoside |
| Formula: | C10 H18 N4 O6 |
| Formal charge: | 0 |
| Formula weight: | 290.273 Da |
| Component type: | D-saccharide |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | 2-azidoethyl 2-(acetylamino)-2-deoxy-beta-D-glucopyranoside |
| OpenEye OEToolkits | 1.7.6 | N-[(2R,3R,4R,5S,6R)-2-(2-azidoethoxy)-6-(hydroxymethyl)-4,5-bis(oxidanyl)oxan-3-yl]ethanamide |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | O=C(NC1C(O)C(O)C(OC1OCC\N=[N+]=[N-])CO)C |
| InChI | InChI | 1.03 | InChI=1S/C10H18N4O6/c1-5(16)13-7-9(18)8(17)6(4-15)20-10(7)19-3-2-12-14-11/h6-10,15,17-18H,2-4H2,1H3,(H,13,16)/t6-,7-,8-,9-,10-/m1/s1 |
| InChIKey | InChI | 1.03 | DHQJPCIPZHPDSL-VVULQXIFSA-N |
| SMILES_CANONICAL | CACTVS | 3.370 | CC(=O)N[C@@H]1[C@@H](O)[C@H](O)[C@@H](CO)O[C@H]1OCCN=[N+]=[N-] |
| SMILES | CACTVS | 3.370 | CC(=O)N[CH]1[CH](O)[CH](O)[CH](CO)O[CH]1OCCN=[N+]=[N-] |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.7.6 | CC(=O)N[C@@H]1[C@H]([C@@H]([C@H](O[C@H]1OCCN=[N+]=[N-])CO)O)O |
| SMILES | OpenEye OEToolkits | 1.7.6 | CC(=O)NC1C(C(C(OC1OCCN=[N+]=[N-])CO)O)O |
