SFE
Summary
| Name: | (3S)-3-amino-3-phenylpropanoic acid |
| Synonyms: | S-BETA-PHENYLALANINE |
| Formula: | C9 H11 N O2 |
| Formal charge: | 0 |
| Formula weight: | 165.189 Da |
| Component type: | PEPTIDE LINKING |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | (3S)-3-amino-3-phenylpropanoic acid |
| OpenEye OEToolkits | 1.7.2 | 3-azanyl-3-phenyl-propanoic acid |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | O=C(O)CC(N)c1ccccc1 |
| SMILES_CANONICAL | CACTVS | 3.370 | N[C@@H](CC(O)=O)c1ccccc1 |
| SMILES | CACTVS | 3.370 | N[CH](CC(O)=O)c1ccccc1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.7.2 | c1ccc(cc1)C(CC(=O)O)N |
| SMILES | OpenEye OEToolkits | 1.7.2 | c1ccc(cc1)C(CC(=O)O)N |
| InChI | InChI | 1.03 | InChI=1S/C9H11NO2/c10-8(6-9(11)12)7-4-2-1-3-5-7/h1-5,8H,6,10H2,(H,11,12)/t8-/m0/s1 |
| InChIKey | InChI | 1.03 | UJOYFRCOTPUKAK-QMMMGPOBSA-N |
