PDB CCD ID: | 0A9 |
Number of entries in BioLiP: | 7 |
Chemical formula: | C10 H13 N O2 |
InChI: | 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: | VSDUZFOSJDMAFZ-VIFPVBQESA-N |
SMILES: | Software | SMILES |
---|
CACTVS 3.370 | COC(=O)[CH](N)Cc1ccccc1 | CACTVS 3.370 | COC(=O)[C@@H](N)Cc1ccccc1 | OpenEye OEToolkits 1.7.0 | COC(=O)[C@H](Cc1ccccc1)N | OpenEye OEToolkits 1.7.0 | COC(=O)C(Cc1ccccc1)N | ACDLabs 12.01 | O=C(OC)C(N)Cc1ccccc1 |
|
Name: | methyl L-phenylalaninate |
ChEMBL: | CHEMBL51969 |
DrugBank: | DB06838 |
ZINC: | ZINC000019419113 |