PPK
Summary
| Name: | (DIPHOSPHONO)AMINOPHOSPHONIC ACID |
| Formula: | H6 N O9 P3 |
| Formal charge: | 0 |
| Formula weight: | 256.97 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 10.04 | phosphonoamidodiphosphoric acid |
| OpenEye OEToolkits | 1.5.0 | [(hydroxy-phosphonooxy-phosphoryl)amino]phosphonic acid |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 10.04 | O=P(OP(=O)(O)O)(O)NP(=O)(O)O |
| SMILES_CANONICAL | CACTVS | 3.341 | O[P](O)(=O)N[P@@](O)(=O)O[P](O)(O)=O |
| SMILES | CACTVS | 3.341 | O[P](O)(=O)N[P](O)(=O)O[P](O)(O)=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | N(P(=O)(O)O)[P@](=O)(O)OP(=O)(O)O |
| SMILES | OpenEye OEToolkits | 1.5.0 | N(P(=O)(O)O)P(=O)(O)OP(=O)(O)O |
| InChI | InChI | 1.03 | InChI=1S/H6NO9P3/c2-11(3,4)1-12(5,6)10-13(7,8)9/h(H2,7,8,9)(H4,1,2,3,4,5,6) |
| InChIKey | InChI | 1.03 | PELPUMGXMYVGSQ-UHFFFAOYSA-N |
