| PDB CCD ID: | HS3 |
| Number of entries in BioLiP: | 1 |
| Chemical formula: | C10 H12 N2 O6 S |
| InChI: | InChI=1S/C10H12N2O6S/c1-18-7-2-4-8(5-3-7)19(16,17)12-9(6-13)10(14)11-15/h2-5,9,12-13H,6H2,1H3/t9-/m1/s1 |
| InChIKey: | LPGVJAGNVVNWCU-SECBINFHSA-N |
| SMILES: | | Software | SMILES |
|---|
| CACTVS 3.341 | COc1ccc(cc1)[S](=O)(=O)N[C@H](CO)C(=O)N=O | | OpenEye OEToolkits 1.5.0 | COc1ccc(cc1)S(=O)(=O)NC(CO)C(=O)N=O | | ACDLabs 10.04 | O=NC(=O)C(NS(=O)(=O)c1ccc(OC)cc1)CO | | OpenEye OEToolkits 1.5.0 | COc1ccc(cc1)S(=O)(=O)N[C@H](CO)C(=O)N=O | | CACTVS 3.341 | COc1ccc(cc1)[S](=O)(=O)N[CH](CO)C(=O)N=O |
|
| Name: | (2R)-3-hydroxy-2-[(4-methoxyphenyl)sulfonylamino]-N-oxo-propanamide;
(R)-N-(3-hydroxy-1-nitroso-1-oxopropan-2-yl)-4-methoxybenzenesulfonamide |
| ZINC: | ZINC000039715705 |
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