DZX
Summary
| Name: | DEOXY-GALACTO-NOEUROSTEGINE |
| Formula: | C8 H15 N O3 |
| Formal charge: | 0 |
| Formula weight: | 173.21 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 1.7.6 | (1R,2R,3S,4R,5S)-2-(hydroxymethyl)-8-azabicyclo[3.2.1]octane-3,4-diol |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.03 | InChI=1S/C8H15NO3/c10-3-4-5-1-2-6(9-5)8(12)7(4)11/h4-12H,1-3H2/t4-,5+,6-,7-,8+/m0/s1 |
| InChIKey | InChI | 1.03 | GQKYZJDPLYFSSX-GWVFRZDISA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | OC[C@@H]1[C@H](O)[C@H](O)[C@@H]2CC[C@H]1N2 |
| SMILES | CACTVS | 3.385 | OC[CH]1[CH](O)[CH](O)[CH]2CC[CH]1N2 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.7.6 | C1C[C@H]2[C@H]([C@H]([C@H]([C@@H]1N2)CO)O)O |
| SMILES | OpenEye OEToolkits | 1.7.6 | C1CC2C(C(C(C1N2)CO)O)O |
