CU0
Summary
| Name: | [(2~{R},3~{S},4~{S})-3,4-bis(oxidanyl)oxolan-2-yl]methyl phosphono hydrogen phosphate |
| Formula: | C5 H12 O10 P2 |
| Formal charge: | 0 |
| Formula weight: | 294.09 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.7 | [(2~{R},3~{S},4~{S})-3,4-bis(oxidanyl)oxolan-2-yl]methyl phosphono hydrogen phosphate |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.03 | InChI=1S/C5H12O10P2/c6-3-1-13-4(5(3)7)2-14-17(11,12)15-16(8,9)10/h3-7H,1-2H2,(H,11,12)(H2,8,9,10)/t3-,4+,5-/m0/s1 |
| InChIKey | InChI | 1.03 | HNPYBPXXPMVWIY-LMVFSUKVSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | O[C@H]1CO[C@H](CO[P](O)(=O)O[P](O)(O)=O)[C@H]1O |
| SMILES | CACTVS | 3.385 | O[CH]1CO[CH](CO[P](O)(=O)O[P](O)(O)=O)[CH]1O |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | C1[C@@H]([C@@H]([C@H](O1)COP(=O)(O)OP(=O)(O)O)O)O |
| SMILES | OpenEye OEToolkits | 2.0.7 | C1C(C(C(O1)COP(=O)(O)OP(=O)(O)O)O)O |
