DTU
Summary
| Name: | (2R,3S)-1,4-DIMERCAPTOBUTANE-2,3-DIOL |
| Formula: | C4 H10 O2 S2 |
| Formal charge: | 0 |
| Formula weight: | 154.251 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 10.04 | (2R,3S)-1,4-disulfanylbutane-2,3-diol |
| OpenEye OEToolkits | 1.5.0 | (2S,3R)-1,4-bis-sulfanylbutane-2,3-diol |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 10.04 | SCC(O)C(O)CS |
| SMILES_CANONICAL | CACTVS | 3.341 | O[C@H](CS)[C@@H](O)CS |
| SMILES | CACTVS | 3.341 | O[CH](CS)[CH](O)CS |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | C([C@H]([C@H](CS)O)O)S |
| SMILES | OpenEye OEToolkits | 1.5.0 | C(C(C(CS)O)O)S |
| InChI | InChI | 1.03 | InChI=1S/C4H10O2S2/c5-3(1-7)4(6)2-8/h3-8H,1-2H2/t3-,4+ |
| InChIKey | InChI | 1.03 | VHJLVAABSRFDPM-ZXZARUISSA-N |
