GDL
Summary
| Name: | 2-(acetylamido)-2-deoxy-D-glucono-1,5-lactone |
| Synonyms: | 2-ACETAMIDO-2-DEOXY-D-GLUCONO-1,5-LACTONE |
| Formula: | C8 H13 N O6 |
| Formal charge: | 0 |
| Formula weight: | 219.192 Da |
| Component type: | D-saccharide |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 10.04 | N-[(3R,4R,5S,6R)-4,5-dihydroxy-6-(hydroxymethyl)-2-oxotetrahydro-2H-pyran-3-yl]acetamide (non-preferred name) |
| OpenEye OEToolkits | 1.5.0 | N-[(3R,4R,5S,6R)-4,5-dihydroxy-6-(hydroxymethyl)-2-oxo-oxan-3-yl]ethanamide |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 10.04 | O=C1OC(CO)C(O)C(O)C1NC(=O)C |
| SMILES_CANONICAL | CACTVS | 3.341 | CC(=O)N[C@@H]1[C@@H](O)[C@H](O)[C@@H](CO)OC1=O |
| SMILES | CACTVS | 3.341 | CC(=O)N[CH]1[CH](O)[CH](O)[CH](CO)OC1=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | CC(=O)N[C@@H]1[C@H]([C@@H]([C@H](OC1=O)CO)O)O |
| SMILES | OpenEye OEToolkits | 1.5.0 | CC(=O)NC1C(C(C(OC1=O)CO)O)O |
| InChI | InChI | 1.03 | InChI=1S/C8H13NO6/c1-3(11)9-5-7(13)6(12)4(2-10)15-8(5)14/h4-7,10,12-13H,2H2,1H3,(H,9,11)/t4-,5-,6-,7-/m1/s1 |
| InChIKey | InChI | 1.03 | NELQYZRSPDCGRQ-DBRKOABJSA-N |
