小分子和化合物库

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显示第112个,产品总数129

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  1. SMI-4a,ATP竞争性Pim激酶抑制剂
      规格或纯度 :
    • ≥98%
    CAS号 : 438190-29-5        Compound CID : 1361334
    分子式: C11H6F3NO2S        分子量: 273.23
    IUPAC Name: (5Z)-5-[[3-(trifluoromethyl)phenyl]methylidene]-1,3-thiazolidine-2,4-dione
    SMILES: C1=CC(=CC(=C1)C(F)(F)F)C=C2C(=O)NC(=O)S2
    InChIKey: NGJLOFCOEOHFKQ-YVMONPNESA-N
    InChI: InChI=1S/C11H6F3NO2S/c12-11(13,14)7-3-1-2-6(4-7)5-8-9(16)15-10(17)18-8/h1-5H,(H,15,16,17)/b8-5-
  2. AZD1208
    CAS号 : 1204144-28-4        Compound CID : 58423153
    分子式: C21H21N3O2S        分子量: 379.48
    IUPAC Name: (5Z)-5-[[2-[(3R)-3-aminopiperidin-1-yl]-3-phenylphenyl]methylidene]-1,3-thiazolidine-2,4-dione
    SMILES: C1CC(CN(C1)C2=C(C=CC=C2C3=CC=CC=C3)C=C4C(=O)NC(=O)S4)N
    InChIKey: MCUJKPPARUPFJM-UWCCDQBKSA-N
    InChI: InChI=1S/C21H21N3O2S/c22-16-9-5-11-24(13-16)19-15(12-18-20(25)23-21(26)27-18)8-4-10-17(19)14-6-2-1-3-7-14/h1-4,6-8,10,12,16H,5,9,11,13,22H2,(H,23,25,26)/b18-12-/t16-/m1/s1
  3. 双辛基马来酰亚胺 IV
    CAS号 : 119139-23-0        Compound CID : 2399
    分子式: C20H13N3O2        分子量: 327.34
    IUPAC Name: 3,4-bis(1H-indol-3-yl)pyrrole-2,5-dione
    SMILES: C1=CC=C2C(=C1)C(=CN2)C3=C(C(=O)NC3=O)C4=CNC5=CC=CC=C54
    InChIKey: DQYBRTASHMYDJG-UHFFFAOYSA-N
    InChI: InChI=1S/C20H13N3O2/c24-19-17(13-9-21-15-7-3-1-5-11(13)15)18(20(25)23-19)14-10-22-16-8-4-2-6-12(14)16/h1-10,21-22H,(H,23,24,25)
  4. 普伐他汀钠
      规格或纯度 :
    • ≥99%
    CAS号 : 81131-70-6        Compound CID : 16759173
    分子式: C23H35O7Na        分子量: 446.5
    IUPAC Name: sodium;(3R,5R)-7-[(1S,2S,6S,8S,8aR)-6-hydroxy-2-methyl-8-[(2S)-2-methylbutanoyl]oxy-1,2,6,7,8,8a-hexahydronaphthalen-1-yl]-3,5-dihydroxyheptanoate
    SMILES: CCC(C)C(=O)OC1CC(C=C2C1C(C(C=C2)C)CCC(CC(CC(=O)[O-])O)O)O.[Na+]
    InChIKey: VWBQYTRBTXKKOG-IYNICTALSA-M
    InChI: InChI=1S/C23H36O7.Na/c1-4-13(2)23(29)30-20-11-17(25)9-15-6-5-14(3)19(22(15)20)8-7-16(24)10-18(26)12-21(27)28;/h5-6,9,13-14,16-20,22,24-26H,4,7-8,10-12H2,1-3H3,(H,27,28);/q;+1/p-1/t13-,14-,16+,17+,18+,19-,20-,22-;/m0./s1
  5. 3-[1-(3-Aminopropyl)-1H-indol-3-YL]-4-(1-methyl-1H-indol-3-YL)-1H-pyrrole-2,5-dione
    CAS号 : 125313-65-7        Compound CID : 2403
    分子式: C24H22N4O2        分子量: 398.5
    IUPAC Name: 3-[1-(3-aminopropyl)indol-3-yl]-4-(1-methylindol-3-yl)pyrrole-2,5-dione
    SMILES: CN1C=C(C2=CC=CC=C21)C3=C(C(=O)NC3=O)C4=CN(C5=CC=CC=C54)CCCN
    InChIKey: UQHKJRCFSLMWIA-UHFFFAOYSA-N
    InChI: InChI=1S/C24H22N4O2/c1-27-13-17(15-7-2-4-9-19(15)27)21-22(24(30)26-23(21)29)18-14-28(12-6-11-25)20-10-5-3-8-16(18)20/h2-5,7-10,13-14H,6,11-12,25H2,1H3,(H,26,29,30)
  6. Apomine
    CAS号 : 126411-13-0        Compound CID : 176405
    分子式: C28H52O7P2        分子量: 562.7
    IUPAC Name: 4-[2,2-bis[di(propan-2-yloxy)phosphoryl]ethyl]-2,6-ditert-butylphenol
    SMILES: CC(C)OP(=O)(C(CC1=CC(=C(C(=C1)C(C)(C)C)O)C(C)(C)C)P(=O)(OC(C)C)OC(C)C)OC(C)C
    InChIKey: YLJOVCWVJCDPLN-UHFFFAOYSA-N
    InChI: InChI=1S/C28H52O7P2/c1-18(2)32-36(30,33-19(3)4)25(37(31,34-20(5)6)35-21(7)8)17-22-15-23(27(9,10)11)26(29)24(16-22)28(12,13)14/h15-16,18-21,25,29H,17H2,1-14H3
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