小分子和化合物库

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显示第112个,产品总数98

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  1. 尼群地平
    CAS号 : 39562-70-4        Compound CID : 4507
    分子式: C18H20N2O6        分子量: 360.36
    IUPAC Name: 5-O-ethyl 3-O-methyl 2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate
    SMILES: CCOC(=O)C1=C(NC(=C(C1C2=CC(=CC=C2)[N+](=O)[O-])C(=O)OC)C)C
    InChIKey: PVHUJELLJLJGLN-UHFFFAOYSA-N
    InChI: InChI=1S/C18H20N2O6/c1-5-26-18(22)15-11(3)19-10(2)14(17(21)25-4)16(15)12-7-6-8-13(9-12)20(23)24/h6-9,16,19H,5H2,1-4H3
  2. IWR-1,Wnt /β-catenin信号传导抑制剂
      规格或纯度 :
    • ≥98%
    CAS号 : 1127442-82-3        Compound CID : 44483163
    分子式: C25H19N3O3        分子量: 409.44
    IUPAC Name: 4-[(1S,2R,6S,7R)-3,5-dioxo-4-azatricyclo[5.2.1.02,6]dec-8-en-4-yl]-N-quinolin-8-ylbenzamide
    SMILES: C1C2C=CC1C3C2C(=O)N(C3=O)C4=CC=C(C=C4)C(=O)NC5=CC=CC6=C5N=CC=C6
    InChIKey: ZGSXEXBYLJIOGF-ALFLXDJESA-N
    InChI: InChI=1S/C25H19N3O3/c29-23(27-19-5-1-3-14-4-2-12-26-22(14)19)15-8-10-18(11-9-15)28-24(30)20-16-6-7-17(13-16)21(20)25(28)31/h1-12,16-17,20-21H,13H2,(H,27,29)/t16-,17+,20-,21+
  3. exo-IWR-1
      规格或纯度 :
    • ≥98%
    CAS号 : 1127442-87-8        Compound CID : 1163034
    分子式: C25H19N3O3        分子量: 409.44
    IUPAC Name: 4-[(1S,2S,6R,7R)-3,5-dioxo-4-azatricyclo[5.2.1.02,6]dec-8-en-4-yl]-N-quinolin-8-ylbenzamide
    SMILES: C1C2C=CC1C3C2C(=O)N(C3=O)C4=CC=C(C=C4)C(=O)NC5=CC=CC6=C5N=CC=C6
    InChIKey: ZGSXEXBYLJIOGF-BTYSMDAFSA-N
    InChI: InChI=1S/C25H19N3O3/c29-23(27-19-5-1-3-14-4-2-12-26-22(14)19)15-8-10-18(11-9-15)28-24(30)20-16-6-7-17(13-16)21(20)25(28)31/h1-12,16-17,20-21H,13H2,(H,27,29)/t16-,17+,20+,21-
  4. 6-氟黄酮
      规格或纯度 :
    • ≥97%
    CAS号 : 1218-82-2        Compound CID : 261395
    分子式: C15H9FO2        分子量: 240.233
    IUPAC Name: 6-fluoro-2-phenylchromen-4-one
    SMILES: C1=CC=C(C=C1)C2=CC(=O)C3=C(O2)C=CC(=C3)F
    InChIKey: OUYOSBQKQPUNJK-UHFFFAOYSA-N
    InChI: InChI=1S/C15H9FO2/c16-11-6-7-14-12(8-11)13(17)9-15(18-14)10-4-2-1-3-5-10/h1-9H
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