5JP
Summary
| Name: | N-methyl-L-serine |
| Formula: | C4 H9 N O3 |
| Formal charge: | 0 |
| Formula weight: | 119.119 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | N-methyl-L-serine |
| OpenEye OEToolkits | 1.9.2 | (2S)-2-(methylamino)-3-oxidanyl-propanoic acid |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | O=C(O)C(CO)NC |
| InChI | InChI | 1.03 | InChI=1S/C4H9NO3/c1-5-3(2-6)4(7)8/h3,5-6H,2H2,1H3,(H,7,8)/t3-/m0/s1 |
| InChIKey | InChI | 1.03 | PSFABYLDRXJYID-VKHMYHEASA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | CN[C@@H](CO)C(O)=O |
| SMILES | CACTVS | 3.385 | CN[CH](CO)C(O)=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.9.2 | CN[C@@H](CO)C(=O)O |
| SMILES | OpenEye OEToolkits | 1.9.2 | CNC(CO)C(=O)O |
