basic_info |
|
| Product_Name： | PG 116800 |
| CAS： | 291533-11-4 |
| EnglishSynonyms： | PG 116800 |
| pro_mdlNumber： | MFCD18782696 |
| pro_acceptors： | 10 |
| pro_donors： | 3 |
| pro_smile： | COc1ccc(cc1)C(=O)Nc2ccc(cc2)S(=O)(=O)NC(CC#CCN3CCOCC3)C(=O)O |
| InChi： | InChI=1S/C24H27N3O7S/c1-33-20-9-5-18(6-10-20)23(28)25-19-7-11-21(12-8-19)35(31,32)26-22(24(29)30)4-2-3-13-27-14-16-34-17-15-27/h5-12,22,26H,4,13-17H2,1H3,(H,25,28)(H,29,30) |
| InChiKey： | InChIKey=JAYVKNDQKXUNOJ-UHFFFAOYSA-N |
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