基本信息 |
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产品名称: | 5BETA-CHOLANIC ACID-3ALPHA,12ALPHA-DIOL-7-ONE DIACETATE |
英文同义词: | 7-DEHYDROCHOLIC ACID DIACETATE ; 5BETA-CHOLANIC ACID-3ALPHA,12ALPHA-DIOL-7-ONE DIACETATE |
MDL号: | MFCD00271374 |
氢键受体数量: | 7 |
氢键供体数量: | 1 |
Smile: | C[C@H](CCC(=O)O)[C@H]1CC[C@@H]2[C@@]1([C@H](C[C@H]3[C@H]2C(=O)C[C@H]4[C@@]3(CC[C@H](C4)OC(=O)C)C)OC(=O)C)C |
InChi: | InChI=1S/C28H42O7/c1-15(6-9-25(32)33)20-7-8-21-26-22(14-24(28(20,21)5)35-17(3)30)27(4)11-10-19(34-16(2)29)12-18(27)13-23(26)31/h15,18-22,24,26H,6-14H2,1-5H3,(H,32,33)/t15-,18+,19-,20-,21+,22+,24+,26+,27+,28-/m1/s1 |
InChiKey: | InChIKey=RQOCCMCXCOZBHF-FYVANECXSA-N |
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