Basic Information |
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| Product Name: | DIGOXIGENIN-3,12-DIACETATE |
| CAS: | 6078-59-7 |
| English Synonyms: | DIGOXIGENIN-3,12-DIACETATE ; DIGOXIGENIN-3,13-DIACETATE |
| MDL Number.: | MFCD00058501 |
| H bond acceptor: | 7 |
| H bond donor: | 1 |
| Smile: | CC(=O)O[C@H]1CC[C@]2([C@@H](C1)CC[C@@H]3[C@@H]2C[C@H]([C@]4([C@@]3(CC[C@@H]4C5=CC(=O)OC5)O)C)OC(=O)C)C |
| InChi: | InChI=1S/C27H38O7/c1-15(28)33-19-7-9-25(3)18(12-19)5-6-21-22(25)13-23(34-16(2)29)26(4)20(8-10-27(21,26)31)17-11-24(30)32-14-17/h11,18-23,31H,5-10,12-14H2,1-4H3/t18-,19+,20-,21-,22+,23-,25+,26+,27+/m1/s1 |
| InChiKey: | InChIKey=PERJXZOIRVHGPJ-SHSBHQNSSA-N |
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