小分子和化合物库

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  1. trans-Ned 19,荧光标记完整细胞中的NAADP受体
      规格或纯度 :
    • ≥98%(HPLC)
    CAS号: 1354235-96-3
    分子式: C30H31FN4O3        分子量: 514.59
    IUPAC Name: (1R,3S)-1-[3-[[4-(2-fluorophenyl)piperazin-1-yl]methyl]-4-methoxyphenyl]-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole-3-carboxylic acid
    SMILES: COC1=C(C=C(C=C1)C2C3=C(CC(N2)C(=O)O)C4=CC=CC=C4N3)CN5CCN(CC5)C6=CC=CC=C6F
    InChIKey: FUHCEERDBRGPQZ-LBNVMWSVSA-N
    InChI: 1S/C30H31FN4O3/c1-38-27-11-10-19(16-20(27)18-34-12-14-35(15-13-34)26-9-5-3-7-23(26)31)28-29-22(17-25(33-28)30(36)37)21-6-2-4-8-24(21)32-29/h2-11,16,25,28,32-33H,12-15,17-18H2,1H3,(H,36,37)/t25-,28+/m0See more
  2. TR 14035,整联蛋白α4β7和α4β1(VLA-4)拮抗剂
      规格或纯度 :
    • ≥98%(HPLC)
    CAS号: 232271-19-1        Compound CID : 9912743
    分子式: C24H21Cl2NO5        分子量: 474.33
    IUPAC Name: (2S)-2-[(2,6-dichlorobenzoyl)amino]-3-[4-(2,6-dimethoxyphenyl)phenyl]propanoic acid
    SMILES: COC1=C(C(=CC=C1)OC)C2=CC=C(C=C2)CC(C(=O)O)NC(=O)C3=C(C=CC=C3Cl)Cl
    InChIKey: DRSJLVGDSNWQBI-SFHVURJKSA-N
    InChI: 1S/C24H21Cl2NO5/c1-31-19-7-4-8-20(32-2)21(19)15-11-9-14(10-12-15)13-18(24(29)30)27-23(28)22-16(25)5-3-6-17(22)26/h3-12,18H,13H2,1-2H3,(H,27,28)(H,29,30)/t18-/m0/s1
  3. TQS,α7nAChRs的正变构调节剂
      规格或纯度 :
    • ≥98%(HPLC)
    CAS号: 353483-92-8        Compound CID : 5038679
    分子式: C22H20N2O2S        分子量: 376.47
    IUPAC Name: 4-naphthalen-1-yl-3a,4,5,9b-tetrahydro-3H-cyclopenta[c]quinoline-8-sulfonamide
    SMILES: C1C=CC2C1C(NC3=C2C=C(C=C3)S(=O)(=O)N)C4=CC=CC5=CC=CC=C54
    InChIKey: SIZWDJIHABLBSP-UHFFFAOYSA-N
    InChI: 1S/C22H20N2O2S/c23-27(25,26)15-11-12-21-20(13-15)17-8-4-10-19(17)22(24-21)18-9-3-6-14-5-1-2-7-16(14)18/h1-9,11-13,17,19,22,24H,10H2,(H2,23,25,26)
  4. TM 5275 钠盐
      规格或纯度 :
    • ≥98%(HPLC)
    CAS号: 1103926-82-4        Compound CID : 53240409
    分子式: C28H27ClN3O5 · Na        分子量: 543.97
    IUPAC Name: sodium;2-[[2-[2-(4-benzhydrylpiperazin-1-yl)-2-oxoethoxy]acetyl]amino]-5-chlorobenzoate
    SMILES: C1CN(CCN1C(C2=CC=CC=C2)C3=CC=CC=C3)C(=O)COCC(=O)NC4=C(C=C(C=C4)Cl)C(=O)[O-].[Na+]
    InChIKey: JSHSGBIWNPQCQZ-UHFFFAOYSA-M
    InChI: 1S/C28H28ClN3O5.Na/c29-22-11-12-24(23(17-22)28(35)36)30-25(33)18-37-19-26(34)31-13-15-32(16-14-31)27(20-7-3-1-4-8-20)21-9-5-2-6-10-21;/h1-12,17,27H,13-16,18-19H2,(H,30,33)(H,35,36);/q;+1/p-1
  5. TM N1324,GPR39激动剂
      规格或纯度 :
    • ≥98%(HPLC)
    CAS号: 1144477-35-9        Compound CID : 135634901
    分子式: C18H13ClFN7O        分子量: 397.79
    IUPAC Name: 4-(2-chloro-4-fluorophenyl)-3-methyl-1-(7H-purin-6-yl)-5,7-dihydro-4H-pyrazolo[3,4-b]pyridin-6-one
    SMILES: CC1=NN(C2=C1C(CC(=O)N2)C3=C(C=C(C=C3)F)Cl)C4=NC=NC5=C4NC=N5
    InChIKey: CYQNVXRIWKKWQG-UHFFFAOYSA-N
    InChI: 1S/C18H13ClFN7O/c1-8-14-11(10-3-2-9(20)4-12(10)19)5-13(28)25-17(14)27(26-8)18-15-16(22-6-21-15)23-7-24-18/h2-4,6-7,11H,5H2,1H3,(H,25,28)(H,21,22,23,24)
  6. Tiplaxtinin,PAI-1抑制剂
      规格或纯度 :
    • ≥98%(HPLC)
    CAS号: 393105-53-8        Compound CID : 6450819
    分子式: C24H16F3NO4        分子量: 439.38
    IUPAC Name: 2-[1-benzyl-5-[4-(trifluoromethoxy)phenyl]indol-3-yl]-2-oxoacetic acid
    SMILES: C1=CC=C(C=C1)CN2C=C(C3=C2C=CC(=C3)C4=CC=C(C=C4)OC(F)(F)F)C(=O)C(=O)O
    InChIKey: ODXQFEWQSHNQNI-UHFFFAOYSA-N
    InChI: 1S/C24H16F3NO4/c25-24(26,27)32-18-9-6-16(7-10-18)17-8-11-21-19(12-17)20(22(29)23(30)31)14-28(21)13-15-4-2-1-3-5-15/h1-12,14H,13H2,(H,30,31)
  7. 2-ThioUTP tetrasodium salt,P2Y2激动剂
      规格或纯度 :
    • ≥98%(HPLC)
    CAS号: 1343364-70-4        Compound CID : 54591573
    分子式: C9H11N2Na4O14P3S        分子量: 588.13
    IUPAC Name: tetrasodium;[[[(2R,3S,4R,5R)-3,4-dihydroxy-5-(4-oxo-2-sulfanylidenepyrimidin-1-yl)oxolan-2-yl]methoxy-oxidophosphoryl]oxy-oxidophosphoryl] phosphate
    SMILES: C1=CN(C(=S)NC1=O)C2C(C(C(O2)COP(=O)([O-])OP(=O)([O-])OP(=O)([O-])[O-])O)O.[Na+].[Na+].[Na+].[Na+]
    InChIKey: QCBCNKBBEOQRRB-ODQFIEKDSA-J
    InChI: 1S/C9H15N2O14P3S.4Na/c12-5-1-2-11(9(29)10-5)8-7(14)6(13)4(23-8)3-22-27(18,19)25-28(20,21)24-26(15,16)17;;;;/h1-2,4,6-8,13-14H,3H2,(H,18,19)(H,20,21)(H,10,12,29)(H2,15,16,17);;;;/q;4*+1/p-4/t4-,6-,7-,8See more
  8. TFB-TBOA,EAAT1和EAAT2阻断剂
      规格或纯度 :
    • ≥98%(HPLC)
    CAS号: 480439-73-4        Compound CID : 52941382
    分子式: C19H17F3N2O6        分子量: 426.35
    IUPAC Name: (2S,3S)-2-amino-3-[[3-[[4-(trifluoromethyl)benzoyl]amino]phenyl]methoxy]butanedioic acid
    SMILES: C1=CC(=CC(=C1)NC(=O)C2=CC=C(C=C2)C(F)(F)F)COC(C(C(=O)O)N)C(=O)O
    InChIKey: LPWONNPEPDHEAI-GJZGRUSLSA-N
    InChI: 1S/C19H17F3N2O6/c20-19(21,22)12-6-4-11(5-7-12)16(25)24-13-3-1-2-10(8-13)9-30-15(18(28)29)14(23)17(26)27/h1-8,14-15H,9,23H2,(H,24,25)(H,26,27)(H,28,29)/t14-,15-/m0/s1
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