N4O
Summary
| Name: | (2R)-2-hydroxy-3-oxobutyl dihydrogen phosphate |
| Formula: | C4 H9 O6 P |
| Formal charge: | 0 |
| Formula weight: | 184.084 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | (2R)-2-hydroxy-3-oxobutyl dihydrogen phosphate |
| OpenEye OEToolkits | 2.0.7 | [(2~{R})-2-oxidanyl-3-oxidanylidene-butyl] dihydrogen phosphate |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | O=P(O)(O)OCC(O)C(C)=O |
| InChI | InChI | 1.03 | InChI=1S/C4H9O6P/c1-3(5)4(6)2-10-11(7,8)9/h4,6H,2H2,1H3,(H2,7,8,9)/t4-/m1/s1 |
| InChIKey | InChI | 1.03 | OKYHYXLCTGGOLM-SCSAIBSYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | CC(=O)[C@H](O)CO[P](O)(O)=O |
| SMILES | CACTVS | 3.385 | CC(=O)[CH](O)CO[P](O)(O)=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | CC(=O)[C@@H](COP(=O)(O)O)O |
| SMILES | OpenEye OEToolkits | 2.0.7 | CC(=O)C(COP(=O)(O)O)O |
