化学生物学

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  1. Traxoprodil (CP101,606),NMDA 拮抗剂
    CAS号 : 134234-12-1        Compound CID : 219101
    分子式: C20H25NO3        分子量: 327.42
    IUPAC Name: 1-[(1S,2S)-1-hydroxy-1-(4-hydroxyphenyl)propan-2-yl]-4-phenylpiperidin-4-ol
    SMILES: CC(C(C1=CC=C(C=C1)O)O)N2CCC(CC2)(C3=CC=CC=C3)O
    InChIKey: QEMSVZNTSXPFJA-HNAYVOBHSA-N
    InChI: InChI=1S/C20H25NO3/c1-15(19(23)16-7-9-18(22)10-8-16)21-13-11-20(24,12-14-21)17-5-3-2-4-6-17/h2-10,15,19,22-24H,11-14H2,1H3/t15-,19+/m0/s1
  2. 外消旋托法替尼
      规格或纯度 :
    • ≥97%
    CAS号 : 1259404-17-5        Compound CID : 9926791
    分子式: C16H20N6O        分子量: 312.377
    IUPAC Name: 3-[(3R,4R)-4-methyl-3-[methyl(7H-pyrrolo[2,3-d]pyrimidin-4-yl)amino]piperidin-1-yl]-3-oxopropanenitrile
    SMILES: CC1CCN(CC1N(C)C2=NC=NC3=C2C=CN3)C(=O)CC#N
    InChIKey: UJLAWZDWDVHWOW-YPMHNXCESA-N
    InChI: InChI=1S/C16H20N6O/c1-11-5-8-22(14(23)3-6-17)9-13(11)21(2)16-12-4-7-18-15(12)19-10-20-16/h4,7,10-11,13H,3,5,8-9H2,1-2H3,(H,18,19,20)/t11-,13+/m1/s1
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