Basic Information |
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| Product Name: | TIPRANOVIR B-D-GLUCURONIDE |
| CAS: | 947408-14-2 |
| English Synonyms: | TIPRANOVIR B-D-GLUCURONIDE ; TIPRANOVIR BETA-D-GLUCURONIDE |
| MDL Number.: | MFCD15145131 |
| H bond acceptor: | 12 |
| H bond donor: | 5 |
| Smile: | CCC[C@@]1(CCC2=CC=CC=C2)CC(=O)C([C@H](CC)C2=CC=CC(NS(=O)(=O)C3=CC=C(C=N3)C(F)(F)F)=C2)=C(C1)O[C@@H]1O[C@@H]([C@@H](O)[C@H](O)[C@H]1O)C(O)=O |
| InChi: | InChI=1S/C38H43F3N2O10S/c1-3-16-37(17-15-22-9-6-5-7-10-22)19-27(44)30(28(20-37)52-36-33(47)31(45)32(46)34(53-36)35(48)49)26(4-2)23-11-8-12-25(18-23)43-54(50,51)29-14-13-24(21-42-29)38(39,40)41/h5-14,18,21,26,31-34,36,43,45-47H,3-4,15-17,19-20H2,1-2H3,(H,48,49)/t26-,31+,32+,33-,34+,36-,37-/m1/s1 |
| InChiKey: | InChIKey=SGYRCNNLFQXEAS-CSOUJSLASA-N |
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