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1,3-Cyclohexanediol,5-[(2E)-2-[(1R,3aS,7aR)-octahydro-1-[(1R)-5-hydroxy-1,5-dimethylhexyl]-7a-methyl-4H-inden-4-ylidene]ethylidene]-,(1R,3S)-

共找到8家“1,3-Cyclohexanediol,5-[(2E)-2-[(1R,3aS,7aR)-octahydro-1-[(1R)-5-hydroxy-1,5-dimethylhexyl]-7a-methyl-4H-inden-4-ylidene]ethylidene]-,(1R,3S)-“产品

名称和标识符

Inchi : InChI=1S/C26H44O3/c1-18(7-5-13-25(2,3)29)23-11-12-24-20(8-6-14-26(23,24)4)10-9-19-15-21(27)17-22(28)16-19/h9-10,18,21-24,27-29H,5-8,11-17H2,1-4H3/b20-10+/t18-,21-,22-,23-,24+,26-/m1/s1

InChIKey : PKFBWEUIKKCWEW-WEZTXPJVSA-N

SMILES : C[C@H](CCCC(C)(C)O)[C@H]1CC[C@H]2/C(=C/C=C3C[C@H](C[C@@H](C3)O)O)/CCC[C@]12C

英文别名
  • 1,3-Cyclohexanediol,5-[(2E)-2-[(1R,3aS,7aR)-octahydro-1-[(1R)-5-hydroxy-1,5-dimethylhexyl]-7a-methyl-4H-inden-4-ylidene]ethylidene]-,(1R,3S)-
  • (1R,3R)-5-[(2E)-2-[(1R,3aS,7aR)-1-[(2R)-6-hydroxy-6-methylheptan-2-yl]-7a-methyl-2,3,3a,5,6,7-hexahydro-1H-inden-4-ylidene]ethylidene]cyclohexane-1,3-diol
  • 1,25-dihydroxy-19-norvitamin D3
  • 1,3-Cyclohexanediol,5-[(2E)-2-[(1R,3aS,7aR)-octahydro-1-[(1R)-5-hydroxy-1,5-dimethylhexyl]-7a-...
  • 1,3-Cyclohexanediol,5-[(2E)-2-[(1R,3aS,7aR)-octahydro-1-[(1R)-5-hydroxy-1,5-dimethylhexyl]-7a-methyl-4H-inden-4-ylidene]ethyl
  • 19-NORCALCITROL
  • (7E)-(1R,3R)-19-nor-9,10-seco-5,7-cholestadiene-1,3,25-triol
  • 19-Nor-22(E)
  • 19-Nor-9,10-secocholesta-5,7-diene-1,3,25-triol, (1alpha,3beta,7E)-
  • 1alpha,25-(OH)2-19-Nor-vitamin D3
  • 1alpha,25-dihydroxy-19-norcholecalciferol
  • 1alpha,25-dihydroxy-19-norvitamin D3
  • 20-Epi-19-nor-1,25-(OH)2 D3
  • CHEMBL119386
  • Ro 27-5256
  • 19-Norcalcitrol
物化性质
计算特性

氢键供体数量 : 3

氢键受体数量 : 3

重原子数量 : 29

可旋转化学键数量 : 6