KPR
Summary
| Name: | [(~{E},4~{S})-4-azanyl-3-oxidanylidene-pent-1-enyl] dihydrogen phosphate |
| Formula: | C5 H10 N O5 P |
| Formal charge: | 0 |
| Formula weight: | 195.11 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.5 | [(~{E},4~{S})-4-azanyl-3-oxidanylidene-pent-1-enyl] dihydrogen phosphate |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.03 | InChI=1S/C5H10NO5P/c1-4(6)5(7)2-3-11-12(8,9)10/h2-4H,6H2,1H3,(H2,8,9,10)/b3-2+/t4-/m0/s1 |
| InChIKey | InChI | 1.03 | RTVKPJRIOVZREZ-ZPYNKGFJSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | C[C@H](N)C(=O)\C=C\O[P](O)(O)=O |
| SMILES | CACTVS | 3.385 | C[CH](N)C(=O)C=CO[P](O)(O)=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.5 | C[C@@H](C(=O)/C=C/OP(=O)(O)O)N |
| SMILES | OpenEye OEToolkits | 2.0.5 | CC(C(=O)C=COP(=O)(O)O)N |
