WEB
Summary
| Name: | alpha-D-psicopyranose |
| Synonyms: | (2~{S},3~{R},4~{R},5~{R})-2-(hydroxymethyl)oxane-2,3,4,5-tetrol |
| Formula: | C6 H12 O6 |
| Formal charge: | 0 |
| Formula weight: | 180.156 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.7 | (2~{S},3~{R},4~{R},5~{R})-2-(hydroxymethyl)oxane-2,3,4,5-tetrol |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.06 | InChI=1S/C6H12O6/c7-2-6(11)5(10)4(9)3(8)1-12-6/h3-5,7-11H,1-2H2/t3-,4-,5-,6+/m1/s1 |
| InChIKey | InChI | 1.06 | LKDRXBCSQODPBY-KAZBKCHUSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | OC[C@]1(O)OC[C@@H](O)[C@@H](O)[C@H]1O |
| SMILES | CACTVS | 3.385 | OC[C]1(O)OC[CH](O)[CH](O)[CH]1O |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | C1[C@H]([C@H]([C@H]([C@@](O1)(CO)O)O)O)O |
| SMILES | OpenEye OEToolkits | 2.0.7 | C1C(C(C(C(O1)(CO)O)O)O)O |
