GYV
Summary
| Name: | 2-acetamido-1-O-carbamoyl-2-deoxy-alpha-D-glucopyranose |
| Synonyms: | 2-(ACETYLAMINO)-1-O-CARBAMOYL-2-DEOXY-ALPHA-D-GLUCOPYRANOSE 2-acetamido-1-O-carbamoyl-2-deoxy-alpha-D-glucose; 2-acetamido-1-O-carbamoyl-2-deoxy-D-glucose; 2-acetamido-1-O-carbamoyl-2-deoxy-glucose |
| Formula: | C9 H16 N2 O7 |
| Formal charge: | 0 |
| Formula weight: | 264.233 Da |
| Component type: | D-saccharide |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 10.04 | 2-(acetylamino)-1-O-carbamoyl-2-deoxy-alpha-D-glucopyranose |
| OpenEye OEToolkits | 1.6.1 | [(2R,3R,4R,5S,6R)-3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl] carbamate |
| PDB-CARE | 1.0 | methyl-a-D-glucopyranoside |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 10.04 | O=C(OC1OC(C(O)C(O)C1NC(=O)C)CO)N |
| SMILES_CANONICAL | CACTVS | 3.352 | CC(=O)N[C@@H]1[C@@H](O)[C@H](O)[C@@H](CO)O[C@@H]1OC(N)=O |
| SMILES | CACTVS | 3.352 | CC(=O)N[CH]1[CH](O)[CH](O)[CH](CO)O[CH]1OC(N)=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.6.1 | CC(=O)N[C@@H]1[C@H]([C@@H]([C@H](O[C@@H]1OC(=O)N)CO)O)O |
| SMILES | OpenEye OEToolkits | 1.6.1 | CC(=O)NC1C(C(C(OC1OC(=O)N)CO)O)O |
| InChI | InChI | 1.03 | InChI=1S/C9H16N2O7/c1-3(13)11-5-7(15)6(14)4(2-12)17-8(5)18-9(10)16/h4-8,12,14-15H,2H2,1H3,(H2,10,16)(H,11,13)/t4-,5-,6-,7-,8-/m1/s1 |
| InChIKey | InChI | 1.03 | BMFDLZBABRHLIB-FMDGEEDCSA-N |
