A1ADZ
Summary
| Name: | (2S)-2-amino-3-(2-methoxyphenyl)propan-1-ol |
| 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 | 2-methoxy-L-phenylalanine |
| OpenEye OEToolkits | 2.0.7 | (2~{S})-2-azanyl-3-(2-methoxyphenyl)propanoic acid |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | COc1ccccc1CC(N)C(=O)O |
| InChI | InChI | 1.06 | InChI=1S/C10H13NO3/c1-14-9-5-3-2-4-7(9)6-8(11)10(12)13/h2-5,8H,6,11H2,1H3,(H,12,13)/t8-/m0/s1 |
| InChIKey | InChI | 1.06 | SEUPQWHWULSGJC-QMMMGPOBSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | COc1ccccc1C[C@H](N)C(O)=O |
| SMILES | CACTVS | 3.385 | COc1ccccc1C[CH](N)C(O)=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | COc1ccccc1C[C@@H](C(=O)O)N |
| SMILES | OpenEye OEToolkits | 2.0.7 | COc1ccccc1CC(C(=O)O)N |
