0A9
Summary
Name: | methyl L-phenylalaninate |
Formula: | C10 H13 N O2 |
Formal charge: | 0 |
Formula weight: | 179.216 Da |
Component type: | L-PEPTIDE LINKING |
Chemical Identifiers
Program | Version | Name |
ACDLabs | 12.01 | methyl L-phenylalaninate |
OpenEye OEToolkits | 1.7.0 | methyl (2S)-2-azanyl-3-phenyl-propanoate |
Chemical Descriptors
Type | Program | Version | Descriptor |
SMILES | ACDLabs | 12.01 | O=C(OC)C(N)Cc1ccccc1 |
SMILES_CANONICAL | CACTVS | 3.370 | COC(=O)[C@@H](N)Cc1ccccc1 |
SMILES | CACTVS | 3.370 | COC(=O)[CH](N)Cc1ccccc1 |
SMILES_CANONICAL | OpenEye OEToolkits | 1.7.0 | COC(=O)[C@H](Cc1ccccc1)N |
SMILES | OpenEye OEToolkits | 1.7.0 | COC(=O)C(Cc1ccccc1)N |
InChI | InChI | 1.03 | InChI=1S/C10H13NO2/c1-13-10(12)9(11)7-8-5-3-2-4-6-8/h2-6,9H,7,11H2,1H3/t9-/m0/s1 |
InChIKey | InChI | 1.03 | VSDUZFOSJDMAFZ-VIFPVBQESA-N |