TQZ
Summary
| Name: | 2-AMINO-3-PENTASULFANYLPROPAN-1-OL |
| Formula: | C3 H7 N O2 S5 |
| Formal charge: | 0 |
| Formula weight: | 249.418 Da |
| Component type: | L-PEPTIDE LINKING |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | 3-pentasulfanyl-L-alanine |
| OpenEye OEToolkits | 1.9.2 | (2R)-2-azanyl-3-(pentasulfanyl)propanoic acid |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | O=C(O)C(N)CSSSSS |
| InChI | InChI | 1.03 | InChI=1S/C3H7NO2S5/c4-2(3(5)6)1-8-10-11-9-7/h2,7H,1,4H2,(H,5,6)/t2-/m0/s1 |
| InChIKey | InChI | 1.03 | CEIOEWJDORMPCY-REOHCLBHSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | N[C@@H](CSSSSS)C(O)=O |
| SMILES | CACTVS | 3.385 | N[CH](CSSSSS)C(O)=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.9.2 | C([C@@H](C(=O)O)N)SSSSS |
| SMILES | OpenEye OEToolkits | 1.9.2 | C(C(C(=O)O)N)SSSSS |
