JAK/STAT 信号通路 - 按“信号通路”分类 - 小分子和化合物库

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木利替尼

规格或纯度 :

Moligand™

≥99%

CAS号: 366017-09-6

分子式: C₂₅H₂₃F₃N₄O₂ 分子量: 468.47

IUPAC Name: 4-[[4-[4-(triazol-1-yl)butyl]phenoxy]methyl]-2-[(E)-2-[4-(trifluoromethyl)phenyl]ethenyl]-1,3-oxazole

SMILES: C1=CC(=CC=C1CCCCN2C=CN=N2)OCC3=COC(=N3)C=CC4=CC=C(C=C4)C(F)(F)F

InChIKey: ZTFBIUXIQYRUNT-MDWZMJQESA-N

InChI: 1S/C25H23F3N4O2/c26-25(27,28)21-9-4-20(5-10-21)8-13-24-30-22(18-34-24)17-33-23-11-6-19(7-12-23)3-1-2-15-32-16-14-29-31-32/h4-14,16,18H,1-3,15,17H2/b13-8+

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硝呋太尔

规格或纯度 :

Moligand™

≥99%

CAS号: 4936-47-4

分子式: C₁₀H₁₁N₃O₅S 分子量: 285.28

IUPAC Name: 5-(methylsulfanylmethyl)-3-[(E)-(5-nitrofuran-2-yl)methylideneamino]-1,3-oxazolidin-2-one

SMILES: CSCC1CN(C(=O)O1)N=CC2=CC=C(O2)[N+](=O)[O-]

InChIKey: SRQKTCXJCCHINN-NYYWCZLTSA-N

InChI: 1S/C10H11N3O5S/c1-19-6-8-5-12(10(14)18-8)11-4-7-2-3-9(17-7)13(15)16/h2-4,8H,5-6H2,1H3/b11-4+

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来那替尼 (HKI-272)

规格或纯度 :

Moligand™

≥99%

CAS号: 698387-09-6

分子式: C₃₀H₂₉ClN₆O₃ 分子量: 557.04

IUPAC Name: (E)-N-[4-[3-chloro-4-(pyridin-2-ylmethoxy)anilino]-3-cyano-7-ethoxyquinolin-6-yl]-4-(dimethylamino)but-2-enamide

SMILES: CCOC1=C(C=C2C(=C1)N=CC(=C2NC3=CC(=C(C=C3)OCC4=CC=CC=N4)Cl)C#N)NC(=O)C=CCN(C)C

InChIKey: JWNPDZNEKVCWMY-VQHVLOKHSA-N

InChI: 1S/C30H29ClN6O3/c1-4-39-28-16-25-23(15-26(28)36-29(38)9-7-13-37(2)3)30(20(17-32)18-34-25)35-21-10-11-27(24(31)14-21)40-19-22-8-5-6-12-33-22/h5-12,14-16,18H,4,13,19H2,1-3H3,(H,34,35)(H,36,38)/b9-7+

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帕拉米韦三水合物

规格或纯度 :

≥99%

CAS号: 1041434-82-5

分子式: C₁₅H₂₈N₄O₄·3H₂O 分子量: 382.45

IUPAC Name: (1S,2S,3S,4R)-3-[(1S)-1-acetamido-2-ethylbutyl]-4-(diaminomethylideneamino)-2-hydroxycyclopentane-1-carboxylic acid;trihydrate

SMILES: CCC(CC)C(C1C(CC(C1O)C(=O)O)N=C(N)N)NC(=O)C.O.O.O

InChIKey: RFUCJKFZFXNIGB-ZBBHRWOZSA-N

InChI: 1S/C15H28N4O4.3H2O/c1-4-8(5-2)12(18-7(3)20)11-10(19-15(16)17)6-9(13(11)21)14(22)23;;;/h8-13,21H,4-6H2,1-3H3,(H,18,20)(H,22,23)(H4,16,17,19);3*1H2/t9-,10+,11+,12-,13+;;;/m0.../s1

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BMS-690514

规格或纯度 :

Moligand™

≥99%

CAS号: 859853-30-8

分子式: C₁₉H₂₄N₆O₂ 分子量: 368.44

IUPAC Name: (3R,4R)-4-amino-1-[[4-(3-methoxyanilino)pyrrolo[2,1-f][1,2,4]triazin-5-yl]methyl]piperidin-3-ol

SMILES: COC1=CC=CC(=C1)NC2=NC=NN3C2=C(C=C3)CN4CCC(C(C4)O)N

InChIKey: CSGQVNMSRKWUSH-IAGOWNOFSA-N

InChI: 1S/C19H24N6O2/c1-27-15-4-2-3-14(9-15)23-19-18-13(5-8-25(18)22-12-21-19)10-24-7-6-16(20)17(26)11-24/h2-5,8-9,12,16-17,26H,6-7,10-11,20H2,1H3,(H,21,22,23)/t16-,17-/m1/s1

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巴瑞克替尼

规格或纯度 :

Moligand™

≥99%

CAS号: 1187594-09-7

分子式: C₁₆H₁₇N₇O₂S 分子量: 371.42

IUPAC Name: 2-[1-ethylsulfonyl-3-[4-(7H-pyrrolo[2,3-d]pyrimidin-4-yl)pyrazol-1-yl]azetidin-3-yl]acetonitrile

SMILES: CCS(=O)(=O)N1CC(C1)(CC#N)N2C=C(C=N2)C3=C4C=CNC4=NC=N3

InChIKey: XUZMWHLSFXCVMG-UHFFFAOYSA-N

InChI: 1S/C16H17N7O2S/c1-2-26(24,25)22-9-16(10-22,4-5-17)23-8-12(7-21-23)14-13-3-6-18-15(13)20-11-19-14/h3,6-8,11H,2,4,9-10H2,1H3,(H,18,19,20)

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CO-1686(AVL-301),EGFR抑制剂

规格或纯度 :

Moligand™

≥99%

CAS号: 1374640-70-6

分子式: C₂₇H₂₈F₃N₇O₃ 分子量: 555.55

IUPAC Name: N-[3-[[2-[4-(4-acetylpiperazin-1-yl)-2-methoxyanilino]-5-(trifluoromethyl)pyrimidin-4-yl]amino]phenyl]prop-2-enamide

SMILES: CC(=O)N1CCN(CC1)C2=CC(=C(C=C2)NC3=NC=C(C(=N3)NC4=CC(=CC=C4)NC(=O)C=C)C(F)(F)F)OC

InChIKey: HUFOZJXAKZVRNJ-UHFFFAOYSA-N

InChI: 1S/C27H28F3N7O3/c1-4-24(39)32-18-6-5-7-19(14-18)33-25-21(27(28,29)30)16-31-26(35-25)34-22-9-8-20(15-23(22)40-3)37-12-10-36(11-13-37)17(2)38/h4-9,14-16H,1,10-13H2,2-3H3,(H,32,39)(H2,31,33,34,35)

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CP-724714

规格或纯度 :

≥99%

CAS号: 537705-08-1 Compound CID : 57345837

分子式: C₂₇H₂₇N₅O₃ 分子量: 469.53

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达克替尼（PF299804、PF299）

规格或纯度 :

≥99%

CAS号: 1110813-31-4

分子式: C₂₄H₂₅ClFN₅O₂ 分子量: 469.94

IUPAC Name: (E)-N-[4-(3-chloro-4-fluoroanilino)-7-methoxyquinazolin-6-yl]-4-piperidin-1-ylbut-2-enamide

SMILES: COC1=C(C=C2C(=C1)N=CN=C2NC3=CC(=C(C=C3)F)Cl)NC(=O)C=CCN4CCCCC4

InChIKey: LVXJQMNHJWSHET-AATRIKPKSA-N

InChI: 1S/C24H25ClFN5O2/c1-33-22-14-20-17(24(28-15-27-20)29-16-7-8-19(26)18(25)12-16)13-21(22)30-23(32)6-5-11-31-9-3-2-4-10-31/h5-8,12-15H,2-4,9-11H2,1H3,(H,30,32)(H,27,28,29)/b6-5+

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盐酸厄洛替尼 (OSI-744)

规格或纯度 :

≥99%

CAS号: 183319-69-9 EC号: 620-491-0

分子式: C₂₂H₂₃N₃O₄·HCl 分子量: 429.9

IUPAC Name: N-(3-ethynylphenyl)-6,7-bis(2-methoxyethoxy)quinazolin-4-amine;hydrochloride

SMILES: COCCOC1=C(C=C2C(=C1)C(=NC=N2)NC3=CC=CC(=C3)C#C)OCCOC.Cl

InChIKey: GTTBEUCJPZQMDZ-UHFFFAOYSA-N

InChI: 1S/C22H23N3O4.ClH/c1-4-16-6-5-7-17(12-16)25-22-18-13-20(28-10-8-26-2)21(29-11-9-27-3)14-19(18)23-15-24-22;/h1,5-7,12-15H,8-11H2,2-3H3,(H,23,24,25);1H

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枸橼酸托法替尼 (CP-690550)

规格或纯度 :

Moligand™

≥99%

CAS号: 540737-29-9

分子式: C₁₆H₂₀N₆O.C₆H₈O₇ 分子量: 504.49

IUPAC Name: 2-hydroxypropane-1,2,3-tricarboxylic acid;3-[(3R,4R)-4-methyl-3-[methyl(7H-pyrrolo[2,3-d]pyrimidin-4-yl)amino]piperidin-1-yl]-3-oxopropanenitrile

SMILES: CC1CCN(CC1N(C)C2=NC=NC3=C2C=CN3)C(=O)CC#N.C(C(=O)O)C(CC(=O)O)(C(=O)O)O

InChIKey: SYIKUFDOYJFGBQ-YLAFAASESA-N

InChI: 1S/C16H20N6O.C6H8O7/c1-11-5-8-22(14(23)3-6-17)9-13(11)21(2)16-12-4-7-18-15(12)19-10-20-16;7-3(8)1-6(13,5(11)12)2-4(9)10/h4,7,10-11,13H,3,5,8-9H2,1-2H3,(H,18,19,20);13H,1-2H2,(H,7,8)(H,9,10)(H,11,12)/tSee more

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吉非替尼 (ZD1839)

规格或纯度 :

Moligand™

≥99%

CAS号: 184475-35-2

分子式: C₂₂H₂₄ClFN₄O₃ 分子量: 446.9

IUPAC Name: N-(3-chloro-4-fluorophenyl)-7-methoxy-6-(3-morpholin-4-ylpropoxy)quinazolin-4-amine

SMILES: COC1=C(C=C2C(=C1)N=CN=C2NC3=CC(=C(C=C3)F)Cl)OCCCN4CCOCC4

InChIKey: XGALLCVXEZPNRQ-UHFFFAOYSA-N

InChI: 1S/C22H24ClFN4O3/c1-29-20-13-19-16(12-21(20)31-8-2-5-28-6-9-30-10-7-28)22(26-14-25-19)27-15-3-4-18(24)17(23)11-15/h3-4,11-14H,2,5-10H2,1H3,(H,25,26,27)

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