DL6
Summary
| Name: | N-(azidoacetyl)-beta-D-glucopyranosylamine |
| Synonyms: | 2-AZIDO-N-((2R,3R,4S,5S,6R)-3,4,5-TRIHYDROXY-6-(HYDROXYMETHYL)-TETRAHYDRO-2H-PYRAN-2-YL)ACETAMIDE N-AZIDOACETYL-BETA-D-GLUCOPYRANOSYLAMINE; N-(azidoacetyl)-beta-D-glucosylamine; N-(azidoacetyl)-D-glucosylamine; N-(azidoacetyl)-glucosylamine |
| Formula: | C8 H14 N4 O6 |
| Formal charge: | 0 |
| Formula weight: | 262.22 Da |
| Component type: | D-saccharide |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 10.04 | N-(azidoacetyl)-beta-D-glucopyranosylamine |
| OpenEye OEToolkits | 1.5.0 | 2-azido-N-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]ethanamide |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 10.04 | O=C(NC1OC(C(O)C(O)C1O)CO)C/N=[N+]=[N-] |
| SMILES_CANONICAL | CACTVS | 3.341 | OC[C@H]1O[C@@H](NC(=O)CN=[N+]=[N-])[C@H](O)[C@@H](O)[C@@H]1O |
| SMILES | CACTVS | 3.341 | OC[CH]1O[CH](NC(=O)CN=[N+]=[N-])[CH](O)[CH](O)[CH]1O |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | C([C@@H]1[C@H]([C@@H]([C@H]([C@@H](O1)NC(=O)CN=[N+]=[N-])O)O)O)O |
| SMILES | OpenEye OEToolkits | 1.5.0 | C(C1C(C(C(C(O1)NC(=O)CN=[N+]=[N-])O)O)O)O |
| InChI | InChI | 1.03 | InChI=1S/C8H14N4O6/c9-12-10-1-4(14)11-8-7(17)6(16)5(15)3(2-13)18-8/h3,5-8,13,15-17H,1-2H2,(H,11,14)/t3-,5-,6+,7-,8-/m1/s1 |
| InChIKey | InChI | 1.03 | ACLUEOOMMLAETN-RHROMQPHSA-N |
