小分子和化合物库

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显示第112个,产品总数122

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  1. 3,5,7,8-四氢-2-甲基-4H-硫代吡喃并[4,3-D]嘧啶-4-酮
      规格或纯度 :
    • ≥98%(HPLC)
    CAS号 : 284028-90-6        Compound CID : 135522417
    分子式: C8H10N2OS        分子量: 182.24
    IUPAC Name: 2-methyl-3,5,7,8-tetrahydrothiopyrano[4,3-d]pyrimidin-4-one
    SMILES: CC1=NC2=C(CSCC2)C(=O)N1
    InChIKey: HRYKZAKEAVZGJD-UHFFFAOYSA-N
    InChI: InChI=1S/C8H10N2OS/c1-5-9-7-2-3-12-4-6(7)8(11)10-5/h2-4H2,1H3,(H,9,10,11)
  2. UPF 1069,PARP2抑制剂
      规格或纯度 :
    • ≥98%
    CAS号 : 1048371-03-4        Compound CID : 25015515
    分子式: C17H13NO3        分子量: 279.29
    IUPAC Name: 5-phenacyloxy-2H-isoquinolin-1-one
    SMILES: C1=CC=C(C=C1)C(=O)COC2=CC=CC3=C2C=CNC3=O
    InChIKey: JJWMRRNGWSITSQ-UHFFFAOYSA-N
    InChI: InChI=1S/C17H13NO3/c19-15(12-5-2-1-3-6-12)11-21-16-8-4-7-14-13(16)9-10-18-17(14)20/h1-10H,11H2,(H,18,20)
  3. 阿魏酸
    CAS号 : 1135-24-6        Compound CID : 445858
    分子式: C10H10O4        分子量: 194.18
    IUPAC Name: (E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoic acid
    SMILES: COC1=C(C=CC(=C1)C=CC(=O)O)O
    InChIKey: KSEBMYQBYZTDHS-HWKANZROSA-N
    InChI: InChI=1S/C10H10O4/c1-14-9-6-7(2-4-8(9)11)3-5-10(12)13/h2-6,11H,1H3,(H,12,13)/b5-3+
  4. 阿魏酸
    CAS号 : 1135-24-6        Compound CID : 445858
    分子式: C10H10O4        分子量: 194.18
    IUPAC Name: (E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoic acid
    SMILES: COC1=C(C=CC(=C1)C=CC(=O)O)O
    InChIKey: KSEBMYQBYZTDHS-HWKANZROSA-N
    InChI: InChI=1S/C10H10O4/c1-14-9-6-7(2-4-8(9)11)3-5-10(12)13/h2-6,11H,1H3,(H,12,13)/b5-3+
  5. 4-氨基-1,8-萘酰亚胺
      规格或纯度 :
    • ≥95%
    CAS号 : 1742-95-6        Compound CID : 1720
    分子式: C12H8N2O2        分子量: 212.2
    IUPAC Name: 6-aminobenzo[de]isoquinoline-1,3-dione
    SMILES: C1=CC2=C(C=CC3=C2C(=C1)C(=O)NC3=O)N
    InChIKey: SSMIFVHARFVINF-UHFFFAOYSA-N
    InChI: InChI=1S/C12H8N2O2/c13-9-5-4-8-10-6(9)2-1-3-7(10)11(15)14-12(8)16/h1-5H,13H2,(H,14,15,16)
  6. 多巴胺
    CAS号 : 51-61-6        Compound CID : 681
    分子式: C8H11NO2        分子量: 153.18
    IUPAC Name: 4-(2-aminoethyl)benzene-1,2-diol
    SMILES: C1=CC(=C(C=C1CCN)O)O
    InChIKey: VYFYYTLLBUKUHU-UHFFFAOYSA-N
    InChI: InChI=1S/C8H11NO2/c9-4-3-6-1-2-7(10)8(11)5-6/h1-2,5,10-11H,3-4,9H2
  7. 多巴胺
    CAS号 : 51-61-6        Compound CID : 681
    分子式: C8H11NO2        分子量: 153.18
    IUPAC Name: 4-(2-aminoethyl)benzene-1,2-diol
    SMILES: C1=CC(=C(C=C1CCN)O)O
    InChIKey: VYFYYTLLBUKUHU-UHFFFAOYSA-N
    InChI: InChI=1S/C8H11NO2/c9-4-3-6-1-2-7(10)8(11)5-6/h1-2,5,10-11H,3-4,9H2
  8. DPQ,PARP-1抑制剂
    CAS号 : 129075-73-6       
    分子式: C18H26N2O2        分子量: 302.41
    IUPAC Name: 5-(4-piperidin-1-ylbutoxy)-3,4-dihydro-2H-isoquinolin-1-one
    SMILES: C1CCN(CC1)CCCCOC2=CC=CC3=C2CCNC3=O
    InChIKey: RVOUDNBEIXGHJY-UHFFFAOYSA-N
    InChI: InChI=1S/C18H26N2O2/c21-18-16-7-6-8-17(15(16)9-10-19-18)22-14-5-4-13-20-11-2-1-3-12-20/h6-8H,1-5,9-14H2,(H,19,21)
  9. Anle138b,寡聚聚集抑制剂
      规格或纯度 :
    • ≥98%(HPLC)
    CAS号 : 882697-00-9        Compound CID : 44608289
    分子式: C16H11BrN2O2        分子量: 343.18
    IUPAC Name: 5-(1,3-benzodioxol-5-yl)-3-(3-bromophenyl)-1H-pyrazole
    SMILES: C1OC2=C(O1)C=C(C=C2)C3=CC(=NN3)C4=CC(=CC=C4)Br
    InChIKey: RCQIIBJSUWYYFU-UHFFFAOYSA-N
    InChI: InChI=1S/C16H11BrN2O2/c17-12-3-1-2-10(6-12)13-8-14(19-18-13)11-4-5-15-16(7-11)21-9-20-15/h1-8H,9H2,(H,18,19)
  10. BYK204165
      规格或纯度 :
    • ≥98%
    CAS号 : 1104546-89-5        Compound CID : 25113764
    分子式: C15H12N2O2        分子量: 252.27
    IUPAC Name: (4Z)-4-[(1-methylpyrrol-2-yl)methylidene]isoquinoline-1,3-dione
    SMILES: CN1C=CC=C1C=C2C3=CC=CC=C3C(=O)NC2=O
    InChIKey: BTYSIDSTHDDAJW-LCYFTJDESA-N
    InChI: InChI=1S/C15H12N2O2/c1-17-8-4-5-10(17)9-13-11-6-2-3-7-12(11)14(18)16-15(13)19/h2-9H,1H3,(H,16,18,19)/b13-9-
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