基本信息 |
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产品名称: | GYPENOSIDE I |
CAS: | 85889-20-9 |
英文同义词: | GYPENOSIDE I |
MDL号: | MFCD18643211 |
氢键受体数量: | 18 |
氢键供体数量: | 12 |
Smile: | CC1([C@@H]2CC[C@@H]3[C@@H]([C@]2(CC[C@@H]1O[C@H]4[C@@H]([C@H]([C@H]([C@H](O4)CO)O)O)O[C@H]5[C@@H]([C@H]([C@@H]([C@H](O5)CO)O)O)O)C)C[C@H]([C@H]6[C@]3(CC[C@@H]6[C@](C)(CCC=C)O[C@H]7[C@@H]([C@H]([C@@H]([C@H](O7)CO)O)O)O)C)O)C |
InChi: | InChI=1S/C45H76O18/c1-7-8-13-45(6,63-40-37(57)34(54)31(51)25(18-47)59-40)21-11-14-44(5)20-9-10-27-42(2,3)28(12-15-43(27,4)22(20)16-23(49)29(21)44)61-41-38(35(55)32(52)26(19-48)60-41)62-39-36(56)33(53)30(50)24(17-46)58-39/h7,20-41,46-57H,1,8-19H2,2-6H3/t20-,21+,22+,23-,24-,25-,26-,27+,28+,29+,30-,31-,32+,33+,34+,35+,36-,37-,38-,39+,40+,41+,43-,44+,45+/m1/s1 |
InChiKey: | InChIKey=DIDHBUVQVOGVBA-FZWVADNSSA-N |
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