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Summary
| Name: | 3-[(R)-[(1R)-1-amino-2-phenylethyl](hydroxy)phosphoryl]propanoic acid |
| Formula: | C11 H16 N O4 P |
| Formal charge: | 0 |
| Formula weight: | 257.223 Da |
| Component type: | peptide-like |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | 3-[(R)-[(1R)-1-amino-2-phenylethyl](hydroxy)phosphoryl]propanoic acid |
| OpenEye OEToolkits | 1.7.0 | 3-[[(1R)-1-azanyl-2-phenyl-ethyl]-hydroxy-phosphoryl]propanoic acid |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | O=C(O)CCP(=O)(O)C(N)Cc1ccccc1 |
| SMILES_CANONICAL | CACTVS | 3.370 | N[C@@H](Cc1ccccc1)[P](O)(=O)CCC(O)=O |
| SMILES | CACTVS | 3.370 | N[CH](Cc1ccccc1)[P](O)(=O)CCC(O)=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.7.0 | c1ccc(cc1)C[C@H](N)[P@@](=O)(CCC(=O)O)O |
| SMILES | OpenEye OEToolkits | 1.7.0 | c1ccc(cc1)CC(N)P(=O)(CCC(=O)O)O |
| InChI | InChI | 1.03 | InChI=1S/C11H16NO4P/c12-10(8-9-4-2-1-3-5-9)17(15,16)7-6-11(13)14/h1-5,10H,6-8,12H2,(H,13,14)(H,15,16)/t10-/m1/s1 |
| InChIKey | InChI | 1.03 | CZMVVDBXWOZCRC-SNVBAGLBSA-N |
