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罗美昔布CAS号 : 220991-20-8 Compound CID : 151166分子式: C15H13ClFNO2 分子量: 293.72IUPAC Name: 2-[2-(2-chloro-6-fluoroanilino)-5-methylphenyl]acetic acidSMILES: CC1=CC(=C(C=C1)NC2=C(C=CC=C2Cl)F)CC(=O)OInChIKey: KHPKQFYUPIUARC-UHFFFAOYSA-NInChI: InChI=1S/C15H13ClFNO2/c1-9-5-6-13(10(7-9)8-14(19)20)18-15-11(16)3-2-4-12(15)17/h2-7,18H,8H2,1H3,(H,19,20)
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白藜芦醇分子式: C14H12O3 分子量: 228.24IUPAC Name: 5-[(E)-2-(4-hydroxyphenyl)ethenyl]benzene-1,3-diolSMILES: C1=CC(=CC=C1C=CC2=CC(=CC(=C2)O)O)OInChIKey: LUKBXSAWLPMMSZ-OWOJBTEDSA-NInChI: InChI=1S/C14H12O3/c15-12-5-3-10(4-6-12)1-2-11-7-13(16)9-14(17)8-11/h1-9,15-17H/b2-1+
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T0901317,LXR激动剂CAS号 : 293754-55-9 Compound CID : 447912分子式: C17H12F9NO3S 分子量: 481.33IUPAC Name: N-[4-(1,1,1,3,3,3-hexafluoro-2-hydroxypropan-2-yl)phenyl]-N-(2,2,2-trifluoroethyl)benzenesulfonamideSMILES: C1=CC=C(C=C1)S(=O)(=O)N(CC(F)(F)F)C2=CC=C(C=C2)C(C(F)(F)F)(C(F)(F)F)OInChIKey: SGIWFELWJPNFDH-UHFFFAOYSA-NInChI: InChI=1S/C17H12F9NO3S/c18-14(19,20)10-27(31(29,30)13-4-2-1-3-5-13)12-8-6-11(7-9-12)15(28,16(21,22)23)17(24,25)26/h1-9,28H,10H2
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2-(2,6-二氯苯氨基)苯乙酸CAS号 : 15307-86-5分子式: C14H11Cl2NO2 分子量: 296.15IUPAC Name: 2-[2-(2,6-dichloroanilino)phenyl]acetic acidSMILES: C1=CC=C(C(=C1)CC(=O)O)NC2=C(C=CC=C2Cl)ClInChIKey: DCOPUUMXTXDBNB-UHFFFAOYSA-NInChI: InChI=1S/C14H11Cl2NO2/c15-10-5-3-6-11(16)14(10)17-12-7-2-1-4-9(12)8-13(18)19/h1-7,17H,8H2,(H,18,19)
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酮咯酸CAS号 : 74103-06-3 Compound CID : 3826分子式: C15H13NO3 分子量: 255.27IUPAC Name: 5-benzoyl-2,3-dihydro-1H-pyrrolizine-1-carboxylic acidSMILES: C1CN2C(=CC=C2C(=O)C3=CC=CC=C3)C1C(=O)OInChIKey: OZWKMVRBQXNZKK-UHFFFAOYSA-NInChI: InChI=1S/C15H13NO3/c17-14(10-4-2-1-3-5-10)13-7-6-12-11(15(18)19)8-9-16(12)13/h1-7,11H,8-9H2,(H,18,19)
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托麦汀CAS号 : 26171-23-3 Compound CID : 5509分子式: C15H15NO3 分子量: 257.28IUPAC Name: 2-[1-methyl-5-(4-methylbenzoyl)pyrrol-2-yl]acetic acidSMILES: CC1=CC=C(C=C1)C(=O)C2=CC=C(N2C)CC(=O)OInChIKey: UPSPUYADGBWSHF-UHFFFAOYSA-NInChI: InChI=1S/C15H15NO3/c1-10-3-5-11(6-4-10)15(19)13-8-7-12(16(13)2)9-14(17)18/h3-8H,9H2,1-2H3,(H,17,18)
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菲诺洛芬CAS号 : 29679-58-1 Compound CID : 3342分子式: C15H14O3 分子量: 242.27IUPAC Name: 2-(3-phenoxyphenyl)propanoic acidSMILES: CC(C1=CC(=CC=C1)OC2=CC=CC=C2)C(=O)OInChIKey: RDJGLLICXDHJDY-UHFFFAOYSA-NInChI: InChI=1S/C15H14O3/c1-11(15(16)17)12-6-5-9-14(10-12)18-13-7-3-2-4-8-13/h2-11H,1H3,(H,16,17)
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SR1001,RORα和RORγt反向激动剂CAS号 : 1335106-03-0 Compound CID : 44241473分子式: C15H13F6N3O4S2 分子量: 477.39IUPAC Name: N-[5-[[4-(1,1,1,3,3,3-hexafluoro-2-hydroxypropan-2-yl)phenyl]sulfamoyl]-4-methyl-1,3-thiazol-2-yl]acetamideSMILES: CC1=C(SC(=N1)NC(=O)C)S(=O)(=O)NC2=CC=C(C=C2)C(C(F)(F)F)(C(F)(F)F)OInChIKey: OZBSSKGBKHOLGA-UHFFFAOYSA-NInChI: InChI=1S/C15H13F6N3O4S2/c1-7-11(29-12(22-7)23-8(2)25)30(27,28)24-10-5-3-9(4-6-10)13(26,14(16,17)18)15(19,20)21/h3-6,24,26H,1-2H3,(H,22,23,25)
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SR 2211,RORγ反向激动剂CAS号 : 1359164-11-6 Compound CID : 51035449分子式: C26H24F7N3O 分子量: 527.48IUPAC Name: 1,1,1,3,3,3-hexafluoro-2-[3-fluoro-4-[4-[[4-(pyridin-4-ylmethyl)piperazin-1-yl]methyl]phenyl]phenyl]propan-2-olSMILES: C1CN(CCN1CC2=CC=C(C=C2)C3=C(C=C(C=C3)C(C(F)(F)F)(C(F)(F)F)O)F)CC4=CC=NC=C4InChIKey: KVHKWAZUPPBMLL-UHFFFAOYSA-NInChI: InChI=1S/C26H24F7N3O/c27-23-15-21(24(37,25(28,29)30)26(31,32)33)5-6-22(23)20-3-1-18(2-4-20)16-35-11-13-36(14-12-35)17-19-7-9-34-10-8-19/h1-10,15,37H,11-14,16-17H2
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甲氯芬那酸分子式: C14H11Cl2NO2 分子量: 296.15IUPAC Name: 2-(2,6-dichloro-3-methylanilino)benzoic acidSMILES: CC1=C(C(=C(C=C1)Cl)NC2=CC=CC=C2C(=O)O)ClInChIKey: SBDNJUWAMKYJOX-UHFFFAOYSA-NInChI: InChI=1S/C14H11Cl2NO2/c1-8-6-7-10(15)13(12(8)16)17-11-5-3-2-4-9(11)14(18)19/h2-7,17H,1H3,(H,18,19)
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GSK2981278CAS号 : 1474110-21-8 Compound CID : 89875987分子式: C25H35NO5S 分子量: 461.61IUPAC Name: N-(4-ethylphenyl)-3-(hydroxymethyl)-N-(2-methylpropyl)-4-(oxan-4-ylmethoxy)benzenesulfonamideSMILES: CCC1=CC=C(C=C1)N(CC(C)C)S(=O)(=O)C2=CC(=C(C=C2)OCC3CCOCC3)COInChIKey: LZLBRISQTJVZNP-UHFFFAOYSA-NInChI: InChI=1S/C25H35NO5S/c1-4-20-5-7-23(8-6-20)26(16-19(2)3)32(28,29)24-9-10-25(22(15-24)17-27)31-18-21-11-13-30-14-12-21/h5-10,15,19,21,27H,4,11-14,16-18H2,1-3H3
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