BIF
Summary
| Name: | (R)-2-AMINO-3-(4-PHENYLCYCLOHEXYL)PROPANOIC ACID |
| Synonyms: | BIPHENYLALANINE |
| Formula: | C15 H15 N O2 |
| Formal charge: | 0 |
| Formula weight: | 241.285 Da |
| Component type: | L-PEPTIDE LINKING |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 10.04 | (2S)-2-amino-3-biphenyl-4-ylpropanoic acid (non-preferred name) |
| OpenEye OEToolkits | 1.5.0 | (2S)-2-amino-3-(4-phenylphenyl)propanoic acid |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 10.04 | O=C(O)C(N)Cc1ccc(cc1)c2ccccc2 |
| SMILES_CANONICAL | CACTVS | 3.341 | N[C@@H](Cc1ccc(cc1)c2ccccc2)C(O)=O |
| SMILES | CACTVS | 3.341 | N[CH](Cc1ccc(cc1)c2ccccc2)C(O)=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | c1ccc(cc1)c2ccc(cc2)C[C@@H](C(=O)O)N |
| SMILES | OpenEye OEToolkits | 1.5.0 | c1ccc(cc1)c2ccc(cc2)CC(C(=O)O)N |
| InChI | InChI | 1.03 | InChI=1S/C15H15NO2/c16-14(15(17)18)10-11-6-8-13(9-7-11)12-4-2-1-3-5-12/h1-9,14H,10,16H2,(H,17,18)/t14-/m0/s1 |
| InChIKey | InChI | 1.03 | JCZLABDVDPYLRZ-AWEZNQCLSA-N |
