KPH
Summary
Name: | [(1R)-1,5-diaminopentyl]phosphonic acid |
Formula: | C5 H15 N2 O3 P |
Formal charge: | 0 |
Formula weight: | 182.158 Da |
Component type: | NON-POLYMER |
Chemical Identifiers
Program | Version | Name |
ACDLabs | 10.04 | [(1R)-1,5-diaminopentyl]phosphonic acid |
OpenEye OEToolkits | 1.5.0 | [(1R)-1,5-diaminopentyl]phosphonic acid |
Chemical Descriptors
Type | Program | Version | Descriptor |
SMILES | ACDLabs | 10.04 | O=P(O)(O)C(N)CCCCN |
SMILES_CANONICAL | CACTVS | 3.341 | NCCCC[C@H](N)[P](O)(O)=O |
SMILES | CACTVS | 3.341 | NCCCC[CH](N)[P](O)(O)=O |
SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | C(CCN)C[C@H](N)P(=O)(O)O |
SMILES | OpenEye OEToolkits | 1.5.0 | C(CCN)CC(N)P(=O)(O)O |
InChI | InChI | 1.03 | InChI=1S/C5H15N2O3P/c6-4-2-1-3-5(7)11(8,9)10/h5H,1-4,6-7H2,(H2,8,9,10)/t5-/m1/s1 |
InChIKey | InChI | 1.03 | LKFHLBGDPDYWSG-RXMQYKEDSA-N |