基本信息 |
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产品名称: | 5BETA-PREGNAN-3ALPHA,6ALPHA,21-TRIOL-20-ONE |
CAS: | 67896-70-2 |
英文同义词: | 5BETA-PREGNAN-3ALPHA,6ALPHA,21-TRIOL-20-ONE |
MDL号: | MFCD00200257 |
氢键受体数量: | 4 |
氢键供体数量: | 3 |
Smile: | C[C@]12CC[C@H]3[C@H]([C@@H]1CC[C@@H]2C(=O)CO)C[C@@H]([C@H]4[C@@]3(CC[C@H](C4)O)C)O |
InChi: | InChI=1S/C21H34O4/c1-20-8-6-15-13(14(20)3-4-16(20)19(25)11-22)10-18(24)17-9-12(23)5-7-21(15,17)2/h12-18,22-24H,3-11H2,1-2H3/t12-,13+,14+,15+,16-,17+,18+,20+,21-/m1/s1 |
InChiKey: | InChIKey=XWVOZMWRTHPMOW-STXMOTMYSA-N |
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