CAF
Summary
| Name: | S-DIMETHYLARSINOYL-CYSTEINE |
| Synonyms: | CYSTEIN-S-YL CACODYLATE |
| Formula: | C5 H12 As N O3 S |
| Formal charge: | 0 |
| Formula weight: | 241.14 Da |
| Component type: | L-PEPTIDE LINKING |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 10.04 | S-(dimethylarsoryl)-L-cysteine |
| OpenEye OEToolkits | 1.5.0 | (2R)-2-amino-3-dimethylarsorylsulfanyl-propanoic acid |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 10.04 | O=C(O)C(N)CS[As](=O)(C)C |
| SMILES_CANONICAL | CACTVS | 3.341 | C[As](C)(=O)SC[C@H](N)C(O)=O |
| SMILES | CACTVS | 3.341 | C[As](C)(=O)SC[CH](N)C(O)=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | C[As](=O)(C)SC[C@@H](C(=O)O)N |
| SMILES | OpenEye OEToolkits | 1.5.0 | C[As](=O)(C)SCC(C(=O)O)N |
| InChI | InChI | 1.03 | InChI=1S/C5H12AsNO3S/c1-6(2,10)11-3-4(7)5(8)9/h4H,3,7H2,1-2H3,(H,8,9)/t4-/m0/s1 |
| InChIKey | InChI | 1.03 | HBKZDQYWGRUTJX-BYPYZUCNSA-N |
