060
Summary
| Name: | S-methyl-D-cysteine |
| Formula: | C4 H9 N O2 S |
| Formal charge: | 0 |
| Formula weight: | 135.185 Da |
| Component type: | D-peptide linking |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | S-methyl-D-cysteine |
| OpenEye OEToolkits | 1.9.2 | (2S)-2-azanyl-3-methylsulfanyl-propanoic acid |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | O=C(O)C(N)CSC |
| InChI | InChI | 1.03 | InChI=1S/C4H9NO2S/c1-8-2-3(5)4(6)7/h3H,2,5H2,1H3,(H,6,7)/t3-/m1/s1 |
| InChIKey | InChI | 1.03 | IDIDJDIHTAOVLG-GSVOUGTGSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | CSC[C@@H](N)C(O)=O |
| SMILES | CACTVS | 3.385 | CSC[CH](N)C(O)=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.9.2 | CSC[C@H](C(=O)O)N |
| SMILES | OpenEye OEToolkits | 1.9.2 | CSCC(C(=O)O)N |
