19N
[(1R)-1-amino-5-carbamimidamidopentyl]phosphonic acid
Created: | 2013-04-15 |
Last modified: | 2013-06-12 |
Find Related PDB Entry |
---|
Find related ligands: |
---|
Chemical Details | |
---|---|
Formal Charge | 0 |
Atom Count | 31 |
Chiral Atom Count | 1 |
Bond Count | 30 |
Aromatic Bond Count | 0 |
Chemical Component Summary | |
---|---|
Name | [(1R)-1-amino-5-carbamimidamidopentyl]phosphonic acid |
Systematic Name (OpenEye OEToolkits) | [(1R)-1-azanyl-5-carbamimidamido-pentyl]phosphonic acid |
Formula | C6 H17 N4 O3 P |
Molecular Weight | 224.198 |
Type | NON-POLYMER |
Chemical Descriptors | |||
---|---|---|---|
Type | Program | Version | Descriptor |
SMILES | ACDLabs | 12.01 | O=P(O)(O)C(N)CCCCNC(=[N@H])N |
SMILES | CACTVS | 3.370 | N[CH](CCCCNC(N)=N)[P](O)(O)=O |
SMILES | OpenEye OEToolkits | 1.7.6 | C(CCNC(=N)N)CC(N)P(=O)(O)O |
Canonical SMILES | CACTVS | 3.370 | N[C@@H](CCCCNC(N)=N)[P](O)(O)=O |
Canonical SMILES | OpenEye OEToolkits | 1.7.6 | [H]/N=C(\N)/NCCCC[C@H](N)P(=O)(O)O |
InChI | InChI | 1.03 | InChI=1S/C6H17N4O3P/c7-5(14(11,12)13)3-1-2-4-10-6(8)9/h5H,1-4,7H2,(H4,8,9,10)(H2,11,12,13)/t5-/m1/s1 |
InChIKey | InChI | 1.03 | GAZYHWYZAQCLLA-RXMQYKEDSA-N |
Related Resource References
Resource Name | Reference |
---|---|
PubChem | 71563401 |