0TK
Summary
| Name: | (2R)-2,5-diaminopentanoyl dihydrogen phosphate |
| Synonyms: | phosphorylated D-ornithine |
| Formula: | C5 H13 N2 O5 P |
| Formal charge: | 0 |
| Formula weight: | 212.141 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | (2R)-2,5-diaminopentanoyl dihydrogen phosphate |
| OpenEye OEToolkits | 1.7.6 | phosphono (2R)-2,5-bis(azanyl)pentanoate |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | O=P(OC(=O)C(N)CCCN)(O)O |
| InChI | InChI | 1.03 | InChI=1S/C5H13N2O5P/c6-3-1-2-4(7)5(8)12-13(9,10)11/h4H,1-3,6-7H2,(H2,9,10,11)/t4-/m1/s1 |
| InChIKey | InChI | 1.03 | MNDHJWIHMSHXOW-SCSAIBSYSA-N |
| SMILES_CANONICAL | CACTVS | 3.370 | NCCC[C@@H](N)C(=O)O[P](O)(O)=O |
| SMILES | CACTVS | 3.370 | NCCC[CH](N)C(=O)O[P](O)(O)=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.7.6 | C(C[C@H](C(=O)OP(=O)(O)O)N)CN |
| SMILES | OpenEye OEToolkits | 1.7.6 | C(CC(C(=O)OP(=O)(O)O)N)CN |
