QM8
Summary
| Name: | 6-Sulfanyl-L-norleucine |
| Synonyms: | (2S)-2-azanyl-6-sulfanyl-hexanoic acid 6-mercaptonorleucine |
| Formula: | C6 H13 N O2 S |
| Formal charge: | 0 |
| Formula weight: | 163.238 Da |
| Component type: | L-peptide linking |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 3.1.0.0 | (2~{S})-2-azanyl-6-sulfanyl-hexanoic acid |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.03 | InChI=1S/C6H13NO2S/c7-5(6(8)9)3-1-2-4-10/h5,10H,1-4,7H2,(H,8,9)/t5-/m0/s1 |
| InChIKey | InChI | 1.03 | HBMWPJLCTYKAGL-YFKPBYRVSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | N[C@@H](CCCCS)C(O)=O |
| SMILES | CACTVS | 3.385 | N[CH](CCCCS)C(O)=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 3.1.0.0 | C(CCS)C[C@@H](C(=O)O)N |
| SMILES | OpenEye OEToolkits | 3.1.0.0 | C(CCS)CC(C(=O)O)N |
