| PDB CCD ID: | Q23 |
| Number of entries in BioLiP: | 0 |
| Chemical formula: | C10 H10 O5 S2 |
| InChI: | InChI=1S/C10H10O5S2/c11-16(12)7-6-9(8-16)15-17(13,14)10-4-2-1-3-5-10/h1-7,9H,8H2/t9-/m1/s1 |
| InChIKey: | RFHUNIXPGHBTTE-SECBINFHSA-N |
| SMILES: | | Software | SMILES |
|---|
| ACDLabs 12.01 | O=S2(=O)C=CC(OS(=O)(=O)c1ccccc1)C2 | | CACTVS 3.370 | O=[S]1(=O)C[CH](O[S](=O)(=O)c2ccccc2)C=C1 | | OpenEye OEToolkits 1.7.0 | c1ccc(cc1)S(=O)(=O)O[C@H]2CS(=O)(=O)C=C2 | | CACTVS 3.370 | O=[S]1(=O)C[C@H](O[S](=O)(=O)c2ccccc2)C=C1 | | OpenEye OEToolkits 1.7.0 | c1ccc(cc1)S(=O)(=O)OC2CS(=O)(=O)C=C2 |
|
| Name: | (3R)-1,1-dioxido-2,3-dihydrothiophen-3-yl benzenesulfonate |
| ZINC: | ZINC000002552021 |
umich.edu