小分子和化合物库

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  1. 雷尼替丁-d6,盐酸盐
      规格或纯度 :
    • ≥95 atom% D6,≥98%
    CAS号: 1185238-09-8
    分子式: C13H17D6ClN4O3S        分子量: 356.9
    IUPAC Name: (E)-1-N'-[2-[[5-[[bis(trideuteriomethyl)amino]methyl]furan-2-yl]methylsulfanyl]ethyl]-1-N-methyl-2-nitroethene-1,1-diamine;hydrochloride
    SMILES: CNC(=C[N+](=O)[O-])NCCSCC1=CC=C(O1)CN(C)C.Cl
    InChIKey: GGWBHVILAJZWKJ-DICWLCDHSA-N
    InChI: 1S/C13H22N4O3S.ClH/c1-14-13(9-17(18)19)15-6-7-21-10-12-5-4-11(20-12)8-16(2)3;/h4-5,9,14-15H,6-8,10H2,1-3H3;1H/b13-9+;/i2D3,3D3;
  2. 二十烷酸-d₃₉酸
      规格或纯度 :
    • ≥98 atom% D,≥97%
    CAS号: 39756-32-6
    分子式: CD3(CD2)18COOH        分子量: 351.77
    IUPAC Name: 2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,12,12,13,13,14,14,15,15,16,16,17,17,18,18,19,19,20,20,20-nonatriacontadeuterioicosanoic acid
    SMILES: CCCCCCCCCCCCCCCCCCCC(=O)O
    InChIKey: VKOBVWXKNCXXDE-BKDZISOFSA-N
    InChI: 1S/C20H40O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20(21)22/h2-19H2,1H3,(H,21,22)/i1D3,2D2,3D2,4D2,5D2,6D2,7D2,8D2,9D2,10D2,11D2,12D2,13D2,14D2,15D2,16D2,17D2,18D2,19D2
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