CG6
Summary
| Name: | beta-Methyl-Cysteine |
| Formula: | C4 H9 N O2 S |
| Formal charge: | 0 |
| Formula weight: | 135.185 Da |
| Component type: | L-peptide linking |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.4 | (2~{R},3~{R})-2-azanyl-3-sulfanyl-butanoic acid |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.03 | InChI=1S/C4H9NO2S/c1-2(8)3(5)4(6)7/h2-3,8H,5H2,1H3,(H,6,7)/t2-,3+/m1/s1 |
| InChIKey | InChI | 1.03 | TYEIDAYBPNPVII-GBXIJSLDSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | C[C@@H](S)[C@H](N)C(O)=O |
| SMILES | CACTVS | 3.385 | C[CH](S)[CH](N)C(O)=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.4 | C[C@H]([C@@H](C(=O)O)N)S |
| SMILES | OpenEye OEToolkits | 2.0.4 | CC(C(C(=O)O)N)S |
