Basic Information |
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Product Name: | SHATAVARIN IV |
CAS: | 113982-32-4 ;84633-34-1 |
English Synonyms: | SHATAVARIN IV |
MDL Number.: | MFCD09264633 |
H bond acceptor: | 17 |
H bond donor: | 9 |
Smile: | C[C@H]1CC[C@@]2([C@H]([C@H]3[C@@H](O2)C[C@@H]4[C@@]3(CC[C@H]5[C@H]4CC[C@H]6[C@@]5(CC[C@@H](C6)O[C@@H]7[C@H]([C@@H]([C@H]([C@@H](O7)CO)O[C@H]8[C@@H]([C@H]([C@@H]([C@H](O8)CO)O)O)O)O)O[C@H]9[C@@H]([C@@H]([C@H]([C@@H](O9)C)O)O)O)C)C)C)OC1 |
InChi: | InChI=1S/C45H74O17/c1-19-8-13-45(55-18-19)20(2)30-27(62-45)15-26-24-7-6-22-14-23(9-11-43(22,4)25(24)10-12-44(26,30)5)57-42-39(61-40-35(52)33(50)31(48)21(3)56-40)37(54)38(29(17-47)59-42)60-41-36(53)34(51)32(49)28(16-46)58-41/h19-42,46-54H,6-18H2,1-5H3/t19-,20-,21-,22+,23-,24+,25-,26-,27-,28+,29-,30-,31-,32+,33+,34-,35+,36+,37+,38-,39-,40-,41-,42-,43-,44-,45+/m0/s1 |
InChiKey: | InChIKey=MTIGBMJVOSJZQH-DMBOYYMUSA-N |
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