小分子和化合物库

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显示第112个,产品总数76

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  1. 安替比林
    CAS号 : 60-80-0        Compound CID : 2206
    分子式: C11H12N2O        分子量: 188.23
    IUPAC Name: 1,5-dimethyl-2-phenylpyrazol-3-one
    SMILES: CC1=CC(=O)N(N1C)C2=CC=CC=C2
    InChIKey: VEQOALNAAJBPNY-UHFFFAOYSA-N
    InChI: InChI=1S/C11H12N2O/c1-9-8-11(14)13(12(9)2)10-6-4-3-5-7-10/h3-8H,1-2H3
  2. 乙酰水杨酸(ASA)
    CAS号 : 50-78-2        Compound CID : 2244
    分子式: C9H8O4        分子量: 180.16
    IUPAC Name: 2-acetyloxybenzoic acid
    SMILES: CC(=O)OC1=CC=CC=C1C(=O)O
    InChIKey: BSYNRYMUTXBXSQ-UHFFFAOYSA-N
    InChI: InChI=1S/C9H8O4/c1-6(10)13-8-5-3-2-4-7(8)9(11)12/h2-5H,1H3,(H,11,12)
  3. 依利罗地
      规格或纯度 :
    • ≥98%(HPLC)
    CAS号 : 119431-25-3        Compound CID : 60703
    分子式: C20H23ClFNO        分子量: 347.85
    IUPAC Name: 1-(4-chlorophenyl)-2-[4-[(4-fluorophenyl)methyl]piperidin-1-yl]ethanol
    SMILES: C1CN(CCC1CC2=CC=C(C=C2)F)CC(C3=CC=C(C=C3)Cl)O
    InChIKey: GGUSQTSTQSHJAH-UHFFFAOYSA-N
    InChI: InChI=1S/C20H23ClFNO/c21-18-5-3-17(4-6-18)20(24)14-23-11-9-16(10-12-23)13-15-1-7-19(22)8-2-15/h1-8,16,20,24H,9-14H2
  4. 安替比林
      规格或纯度 :
    • ≥99%
    CAS号 : 60-80-0        Compound CID : 2206
    分子式: C11H12N2O        分子量: 188.23
    IUPAC Name: 1,5-dimethyl-2-phenylpyrazol-3-one
    SMILES: CC1=CC(=O)N(N1C)C2=CC=CC=C2
    InChIKey: VEQOALNAAJBPNY-UHFFFAOYSA-N
    InChI: InChI=1S/C11H12N2O/c1-9-8-11(14)13(12(9)2)10-6-4-3-5-7-10/h3-8H,1-2H3
  5. Ro 25-6981
      规格或纯度 :
    • ≥98%
    CAS号 : 169274-78-6        Compound CID : 6604887
    分子式: C22H29NO2        分子量: 339.47
    IUPAC Name: 4-[(1R,2S)-3-(4-benzylpiperidin-1-yl)-1-hydroxy-2-methylpropyl]phenol
    SMILES: CC(CN1CCC(CC1)CC2=CC=CC=C2)C(C3=CC=C(C=C3)O)O
    InChIKey: WVZSEUPGUDIELE-HTAPYJJXSA-N
    InChI: InChI=1S/C22H29NO2/c1-17(22(25)20-7-9-21(24)10-8-20)16-23-13-11-19(12-14-23)15-18-5-3-2-4-6-18/h2-10,17,19,22,24-25H,11-16H2,1H3/t17-,22+/m0/s1
  6. Ro 25-6981马来酸盐
      规格或纯度 :
    • ≥98%
    CAS号 : 169274-78-6        Compound CID : 6604887
    分子式: C22H29NO2        分子量: 339.47
    IUPAC Name: 4-[(1R,2S)-3-(4-benzylpiperidin-1-yl)-1-hydroxy-2-methylpropyl]phenol
    SMILES: CC(CN1CCC(CC1)CC2=CC=CC=C2)C(C3=CC=C(C=C3)O)O
    InChIKey: WVZSEUPGUDIELE-HTAPYJJXSA-N
    InChI: InChI=1S/C22H29NO2/c1-17(22(25)20-7-9-21(24)10-8-20)16-23-13-11-19(12-14-23)15-18-5-3-2-4-6-18/h2-10,17,19,22,24-25H,11-16H2,1H3/t17-,22+/m0/s1
  7. 羟布宗
    CAS号 : 129-20-4        Compound CID : 4641
    分子式: C19H20N2O3        分子量: 324.37
    IUPAC Name: 4-butyl-1-(4-hydroxyphenyl)-2-phenylpyrazolidine-3,5-dione
    SMILES: CCCCC1C(=O)N(N(C1=O)C2=CC=C(C=C2)O)C3=CC=CC=C3
    InChIKey: HFHZKZSRXITVMK-UHFFFAOYSA-N
    InChI: InChI=1S/C19H20N2O3/c1-2-3-9-17-18(23)20(14-7-5-4-6-8-14)21(19(17)24)15-10-12-16(22)13-11-15/h4-8,10-13,17,22H,2-3,9H2,1H3
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