基本信息 |
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产品名称: | 3-(((1R,3S,Z)-3-HYDROXY-5-((E)-2-((1R,3AS,7AR)-1-((R)-6-HYDROXY-6-METHYLHEPTAN-2-YL)-7A-METHYLHEXAHYDRO-1H-INDEN-4(2H)-YLIDENE)ETHYLIDENE)-4-METHYLENECYCLOHEXYL)OXY)PROPANENITRILE |
英文同义词: | CALCITRIOL DERIVATIVES ; 3-(((1R,3S,Z)-3-HYDROXY-5-((E)-2-((1R,3AS,7AR)-1-((R)-6-HYDROXY-6-METHYLHEPTAN-2-YL)-7A-METHYLHEXAHYDRO-1H-INDEN-4(2H)-YLIDENE)ETHYLIDENE)-4-METHYLENECYCLOHEXYL)OXY)PROPANENITRILE |
MDL号: | MFCD23098772 |
氢键受体数量: | 4 |
氢键供体数量: | 2 |
Smile: | C[C@H](CCCC(C)(C)O)[C@H]1CC[C@H]\2[C@@]1(CCC/C2=C\C=C/3\C[C@H](C[C@@H](C3=C)O)OCCC#N)C |
InChi: | InChI=1S/C30H47NO3/c1-21(9-6-15-29(3,4)33)26-13-14-27-23(10-7-16-30(26,27)5)11-12-24-19-25(34-18-8-17-31)20-28(32)22(24)2/h11-12,21,25-28,32-33H,2,6-10,13-16,18-20H2,1,3-5H3/b23-11+,24-12-/t21-,25-,26-,27-,28+,30-/m1/s1 |
InChiKey: | InChIKey=JEXMJWGETRFCMK-FUDBZTQOSA-N |
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