基本信息 |
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产品名称: | 重楼皂苷I |
CAS: | 50773-41-6 |
中文同义词: | 重楼皂苷I ; 重楼皂甙A |
英文同义词: | POLYPHYLLIN I ; CHONGLOU SAPONIN I ; POLYPHYLLIN A |
MDL号: | MFCD12407435 |
氢键受体数量: | 16 |
氢键供体数量: | 8 |
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=C6[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](O8)CO)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/C44H70O16/c1-19-8-13-44(53-18-19)20(2)30-27(60-44)15-26-24-7-6-22-14-23(9-11-42(22,4)25(24)10-12-43(26,30)5)55-41-38(59-39-35(51)33(49)31(47)21(3)54-39)36(52)37(29(17-46)57-41)58-40-34(50)32(48)28(16-45)56-40/h6,19-21,23-41,45-52H,7-18H2,1-5H3/t19-,20+,21+,23+,24-,25+,26+,27+,28+,29-,30+,31+,32+,33-,34-,35-,36+,37-,38-,39+,40+,41-,42+,43+,44-/m1/s1 |
InChiKey: | InChIKey=LRRDDWMXYOSKIC-IPKCVOQPSA-N |
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