basic_info |
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| Product_Name: | 7-(3-((2-HYDROXY-2-(6-HYDROXY-M-TOLYL)ETHYL)AMINO)BUTYL)THEOPHYLLINE |
| CAS: | 73908-77-7 |
| EnglishSynonyms: | 7-(3-((2-HYDROXY-2-(6-HYDROXY-M-TOLYL)ETHYL)AMINO)BUTYL)THEOPHYLLINE |
| pro_mdlNumber: | MFCD01682222 |
| pro_acceptors: | 9 |
| pro_donors: | 3 |
| pro_smile: | Cc1ccc(c(c1)C(CNC(C)CCn2cnc3c2c(=O)n(c(=O)n3C)C)O)O |
| InChi: | InChI=1S/C20H27N5O4/c1-12-5-6-15(26)14(9-12)16(27)10-21-13(2)7-8-25-11-22-18-17(25)19(28)24(4)20(29)23(18)3/h5-6,9,11,13,16,21,26-27H,7-8,10H2,1-4H3 |
| InChiKey: | InChIKey=RDGCNOCNCKUXFK-UHFFFAOYSA-N |
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