ETHYNYL ESTRADIOL-3-GLUCURONIDE

CAS号
60134-76-1
CCD编号
CCD02755991
分子式
C26 H32 O8
分子量
472.531

基本信息

产品名称: ETHYNYL ESTRADIOL-3-GLUCURONIDE
CAS: 60134-76-1
英文同义词: ETHYNYL ESTRADIOL-3-GLUCURONIDE ; ETHYNYL ESTRADIOL 3-BETA-D-GLUCURONIDE
MDL号: MFCD16294857
氢键受体数量: 8
氢键供体数量: 5
Smile: C[C@]12CC[C@@H]3c4ccc(cc4CC[C@H]3[C@@H]1CC[C@]2(C#C)O)O[C@H]5[C@@H]([C@H]([C@@H]([C@H](O5)C(=O)O)O)O)O
InChi: InChI=1S/C26H32O8/c1-3-26(32)11-9-18-17-6-4-13-12-14(5-7-15(13)16(17)8-10-25(18,26)2)33-24-21(29)19(27)20(28)22(34-24)23(30)31/h1,5,7,12,16-22,24,27-29,32H,4,6,8-11H2,2H3,(H,30,31)/t16-,17-,18+,19+,20+,21-,22+,24-,25+,26+/m1/s1
InChiKey: InChIKey=DYBBEZHAELJFKW-IWTIIAAJSA-N

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