5BETA-PREGNAN-3ALPHA,6ALPHA,21-TRIOL-20-ONE

CAS号
67896-70-2
CCD编号
CCD00093330
分子式
C21 H34 O4
分子量
350.496

基本信息

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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