| PDB CCD ID: | 8NT |
| Number of entries in BioLiP: | 1 |
| Chemical formula: | C11 H21 N O4 S3 |
| InChI: | InChI=1S/C11H21NO4S3/c13-11(12-7-3-9-19(14,15)16)5-2-1-4-10-6-8-17-18-10/h10H,1-9H2,(H,12,13)(H,14,15,16)/t10-/m0/s1 |
| InChIKey: | SZYIEKXYLQGLFW-JTQLQIEISA-N |
| SMILES: | | Software | SMILES |
|---|
| OpenEye OEToolkits 2.0.6 | C1CSSC1CCCCC(=O)NCCCS(=O)(=O)O | | OpenEye OEToolkits 2.0.6 | C1CSS[C@H]1CCCCC(=O)NCCCS(=O)(=O)O | | CACTVS 3.385 | O[S](=O)(=O)CCCNC(=O)CCCC[C@H]1CCSS1 | | CACTVS 3.385 | O[S](=O)(=O)CCCNC(=O)CCCC[CH]1CCSS1 |
|
| Name: | 3-[5-[(3~{S})-1,2-dithiolan-3-yl]pentanoylamino]propane-1-sulfonic acid |
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