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. 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. LY404039
      规格或纯度 :
    • ≥98%
    CAS号 : 635318-11-5        Compound CID : 9834591
    分子式: C7H9NO6S        分子量: 235.21
    IUPAC Name: (1R,4S,5S,6S)-4-amino-2,2-dioxo-2λ6-thiabicyclo[3.1.0]hexane-4,6-dicarboxylic acid
    SMILES: C1C(C2C(C2S1(=O)=O)C(=O)O)(C(=O)O)N
    InChIKey: AVDUGNCTZRCAHH-MDASVERJSA-N
    InChI: InChI=1S/C7H9NO6S/c8-7(6(11)12)1-15(13,14)4-2(3(4)7)5(9)10/h2-4H,1,8H2,(H,9,10)(H,11,12)/t2-,3-,4+,7+/m1/s1
  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. VU 6001966,mGlu2受体的负变构调节剂
      规格或纯度 :
    • ≥98%(HPLC)
    CAS号 : 2009052-76-8        Compound CID : 122539788
    分子式: C17H15FN4O2        分子量: 326.33
    IUPAC Name: 4-(4-fluorophenyl)-5-[(1-methylpyrazol-3-yl)methoxy]pyridine-2-carboxamide
    SMILES: CN1C=CC(=N1)COC2=CN=C(C=C2C3=CC=C(C=C3)F)C(=O)N
    InChIKey: SSSNPJKQBYVHBV-UHFFFAOYSA-N
    InChI: InChI=1S/C17H15FN4O2/c1-22-7-6-13(21-22)10-24-16-9-20-15(17(19)23)8-14(16)11-2-4-12(18)5-3-11/h2-9H,10H2,1H3,(H2,19,23)
  6. 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
  7. LY404039
      规格或纯度 :
    • 2mM in DMSO
    CAS号 : 635318-11-5        Compound CID : 9834591
    分子式: C7H9NO6S        分子量: 235.21
    IUPAC Name: (1R,4S,5S,6S)-4-amino-2,2-dioxo-2λ6-thiabicyclo[3.1.0]hexane-4,6-dicarboxylic acid
    SMILES: C1C(C2C(C2S1(=O)=O)C(=O)O)(C(=O)O)N
    InChIKey: AVDUGNCTZRCAHH-MDASVERJSA-N
    InChI: InChI=1S/C7H9NO6S/c8-7(6(11)12)1-15(13,14)4-2(3(4)7)5(9)10/h2-4H,1,8H2,(H,9,10)(H,11,12)/t2-,3-,4+,7+/m1/s1
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