HPD
Summary
| Name: | 1-HYDROXY-PENTANE-3,4-DIOL-5-PHOSPHATE |
| Synonyms: | OPEN FORM OF 2'-DEOXY-RIBOFURANOSE-5'-PHOSPHATE |
| Formula: | C5 H13 O7 P |
| Formal charge: | 0 |
| Formula weight: | 216.126 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 10.04 | 2-deoxy-5-O-phosphono-D-erythro-pentitol |
| OpenEye OEToolkits | 1.5.0 | [(2R,3S)-2,3,5-trihydroxypentyl] dihydrogen phosphate |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 10.04 | O=P(O)(O)OCC(O)C(O)CCO |
| SMILES_CANONICAL | CACTVS | 3.341 | OCC[C@H](O)[C@H](O)CO[P](O)(O)=O |
| SMILES | CACTVS | 3.341 | OCC[CH](O)[CH](O)CO[P](O)(O)=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | C(CO)[C@@H]([C@@H](COP(=O)(O)O)O)O |
| SMILES | OpenEye OEToolkits | 1.5.0 | C(CO)C(C(COP(=O)(O)O)O)O |
| InChI | InChI | 1.03 | InChI=1S/C5H13O7P/c6-2-1-4(7)5(8)3-12-13(9,10)11/h4-8H,1-3H2,(H2,9,10,11)/t4-,5+/m0/s1 |
| InChIKey | InChI | 1.03 | YCHBTVQJICBXEI-CRCLSJGQSA-N |
