ZB2
Summary
| Name: | 2-O-methyl-alpha-D-glucopyranose |
| Formula: | C7 H14 O6 |
| Formal charge: | 0 |
| Formula weight: | 194.182 Da |
| Component type: | D-saccharide, alpha linking |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | 2-O-methyl-alpha-D-glucopyranose |
| OpenEye OEToolkits | 1.7.6 | (2S,3R,4S,5S,6R)-6-(hydroxymethyl)-3-methoxy-oxane-2,4,5-triol |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | O(C)C1C(O)C(O)C(OC1O)CO |
| InChI | InChI | 1.03 | InChI=1S/C7H14O6/c1-12-6-5(10)4(9)3(2-8)13-7(6)11/h3-11H,2H2,1H3/t3-,4-,5+,6-,7+/m1/s1 |
| InChIKey | InChI | 1.03 | UMPNFVHHMOSNAC-ZFYZTMLRSA-N |
| SMILES_CANONICAL | CACTVS | 3.370 | CO[C@H]1[C@@H](O)O[C@H](CO)[C@@H](O)[C@@H]1O |
| SMILES | CACTVS | 3.370 | CO[CH]1[CH](O)O[CH](CO)[CH](O)[CH]1O |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.7.6 | CO[C@@H]1[C@H]([C@@H]([C@H](O[C@@H]1O)CO)O)O |
| SMILES | OpenEye OEToolkits | 1.7.6 | COC1C(C(C(OC1O)CO)O)O |
