basic_info |
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| Product_Name: | 7-(3-((2-HYDROXY-2-(P-HYDROXYPHENYL)ETHYL)AMINO)PROPYL)THEOPHYLLINE |
| CAS: | 62401-81-4 |
| EnglishSynonyms: | 7-(3-((2-HYDROXY-2-(P-HYDROXYPHENYL)ETHYL)AMINO)PROPYL)THEOPHYLLINE |
| pro_mdlNumber: | MFCD01682221 |
| pro_acceptors: | 9 |
| pro_donors: | 3 |
| pro_smile: | Cn1c2c(c(=O)n(c1=O)C)n(cn2)CCCNCC(c3ccc(cc3)O)O |
| InChi: | InChI=1S/C18H23N5O4/c1-21-16-15(17(26)22(2)18(21)27)23(11-20-16)9-3-8-19-10-14(25)12-4-6-13(24)7-5-12/h4-7,11,14,19,24-25H,3,8-10H2,1-2H3 |
| InChiKey: | InChIKey=ZEMKRIDQIPFARX-UHFFFAOYSA-N |
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