Obsolete: DPH
Summary
Name: | DEAMINO-METHYL-PHENYLALANINE |
Formula: | C10 H12 O2 |
Formal charge: | 0 |
Formula weight: | 164.201 Da |
Component type: | NON-POLYMER |
Chemical Identifiers
Program | Version | Name |
ACDLabs | 10.04 | (2S)-2-methyl-3-phenylpropanoic acid |
OpenEye OEToolkits | 1.5.0 | (2S)-2-methyl-3-phenyl-propanoic acid |
Chemical Descriptors
Type | Program | Version | Descriptor |
SMILES | ACDLabs | 10.04 | O=C(O)C(C)Cc1ccccc1 |
SMILES_CANONICAL | CACTVS | 3.341 | C[C@@H](Cc1ccccc1)C(O)=O |
SMILES | CACTVS | 3.341 | C[CH](Cc1ccccc1)C(O)=O |
SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | C[C@@H](Cc1ccccc1)C(=O)O |
SMILES | OpenEye OEToolkits | 1.5.0 | CC(Cc1ccccc1)C(=O)O |
InChI | InChI | 1.03 | InChI=1S/C10H12O2/c1-8(10(11)12)7-9-5-3-2-4-6-9/h2-6,8H,7H2,1H3,(H,11,12)/t8-/m0/s1 |
InChIKey | InChI | 1.03 | MCIIDRLDHRQKPH-QMMMGPOBSA-N |