A1CCW
Summary
| Name: | 2-O-acetyl-6-deoxy-alpha-D-talopyranose |
| Formula: | C8 H14 O6 |
| Formal charge: | 0 |
| Formula weight: | 206.193 Da |
| Component type: | D-saccharide, alpha linking |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 14.52 | 2-O-acetyl-6-deoxy-alpha-D-talopyranose |
| OpenEye OEToolkits | 3.1.0.0 | [(3~{S},4~{S},5~{R},6~{R})-6-methyl-2,4,5-tris(oxidanyl)oxan-3-yl] ethanoate |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 14.52 | OC1OC(C)C(O)C(O)C1OC(C)=O |
| InChI | InChI | 1.06 | InChI=1S/C8H14O6/c1-3-5(10)6(11)7(8(12)13-3)14-4(2)9/h3,5-8,10-12H,1-2H3/t3-,5+,6+,7+,8+/m1/s1 |
| InChIKey | InChI | 1.06 | JAMRSAWASNAFCK-FDQSEENZSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | C[C@H]1O[C@H](O)[C@@H](OC(C)=O)[C@@H](O)[C@H]1O |
| SMILES | CACTVS | 3.385 | C[CH]1O[CH](O)[CH](OC(C)=O)[CH](O)[CH]1O |
| SMILES_CANONICAL | OpenEye OEToolkits | 3.1.0.0 | C[C@@H]1[C@@H]([C@@H]([C@@H](C(O1)O)OC(=O)C)O)O |
| SMILES | OpenEye OEToolkits | 3.1.0.0 | CC1C(C(C(C(O1)O)OC(=O)C)O)O |
