YX1
Summary
| Name: | 2-deoxy-2-{[(2-hydroxy-1-methylhydrazino)carbonyl]amino}-beta-D-glucopyranose |
| Synonyms: | 2-deoxy-2-{[(2-hydroxy-1-methylhydrazino)carbonyl]amino}-beta-D-glucose 2-deoxy-2-{[(2-hydroxy-1-methylhydrazino)carbonyl]amino}-D-glucose; 2-deoxy-2-{[(2-hydroxy-1-methylhydrazino)carbonyl]amino}-glucose |
| Formula: | C8 H17 N3 O7 |
| Formal charge: | 0 |
| Formula weight: | 267.236 Da |
| Component type: | D-saccharide |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 10.04 | 2-deoxy-2-{[(2-hydroxy-1-methylhydrazino)carbonyl]amino}-beta-D-glucopyranose |
| OpenEye OEToolkits | 1.5.0 | 1-(hydroxyamino)-1-methyl-3-[(2R,3R,4R,5S,6R)-2,4,5-trihydroxy-6-(hydroxymethyl)oxan-3-yl]urea |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 10.04 | O=C(NC1C(O)C(O)C(OC1O)CO)N(NO)C |
| SMILES_CANONICAL | CACTVS | 3.341 | CN(NO)C(=O)N[C@H]1[C@H](O)O[C@H](CO)[C@@H](O)[C@@H]1O |
| SMILES | CACTVS | 3.341 | CN(NO)C(=O)N[CH]1[CH](O)O[CH](CO)[CH](O)[CH]1O |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | CN(C(=O)N[C@@H]1[C@H]([C@@H]([C@H](O[C@H]1O)CO)O)O)NO |
| SMILES | OpenEye OEToolkits | 1.5.0 | CN(C(=O)NC1C(C(C(OC1O)CO)O)O)NO |
| InChI | InChI | 1.03 | InChI=1S/C8H17N3O7/c1-11(10-17)8(16)9-4-6(14)5(13)3(2-12)18-7(4)15/h3-7,10,12-15,17H,2H2,1H3,(H,9,16)/t3-,4-,5-,6-,7-/m1/s1 |
| InChIKey | InChI | 1.03 | LUNQAAUVSFIVKD-NYMZXIIRSA-N |
