WPA
Summary
| Name: | (betaR)-beta-methoxy-L-phenylalanine |
| Formula: | C10 H13 N O3 |
| Formal charge: | 0 |
| Formula weight: | 195.215 Da |
| Component type: | L-PEPTIDE LINKING |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | (betaR)-beta-methoxy-L-phenylalanine |
| OpenEye OEToolkits | 1.7.6 | (2S,3R)-2-azanyl-3-methoxy-3-phenyl-propanoic acid |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | O=C(O)C(N)C(OC)c1ccccc1 |
| InChI | InChI | 1.03 | InChI=1S/C10H13NO3/c1-14-9(8(11)10(12)13)7-5-3-2-4-6-7/h2-6,8-9H,11H2,1H3,(H,12,13)/t8-,9+/m0/s1 |
| InChIKey | InChI | 1.03 | KKXIHXAQVMPMHW-DTWKUNHWSA-N |
| SMILES_CANONICAL | CACTVS | 3.370 | CO[C@@H]([C@H](N)C(O)=O)c1ccccc1 |
| SMILES | CACTVS | 3.370 | CO[CH]([CH](N)C(O)=O)c1ccccc1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.7.6 | CO[C@H](c1ccccc1)[C@@H](C(=O)O)N |
| SMILES | OpenEye OEToolkits | 1.7.6 | COC(c1ccccc1)C(C(=O)O)N |
