化学生物学
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钙离子载体 A23187CAS号 : 52665-69-7 Compound CID : 11957499分子式: C29H37N3O6 分子量: 523.62IUPAC Name: 5-(methylamino)-2-[[(2S,3R,5R,6S,8R,9R)-3,5,9-trimethyl-2-[(2S)-1-oxo-1-(1H-pyrrol-2-yl)propan-2-yl]-1,7-dioxaspiro[5.5]undecan-8-yl]methyl]-1,3-benzoxazole-4-carboxylic acidSMILES: CC1CCC2(C(CC(C(O2)C(C)C(=O)C3=CC=CN3)C)C)OC1CC4=NC5=C(O4)C=CC(=C5C(=O)O)NCInChIKey: HIYAVKIYRIFSCZ-CYEMHPAKSA-NInChI: InChI=1S/C29H37N3O6/c1-15-10-11-29(17(3)13-16(2)27(38-29)18(4)26(33)20-7-6-12-31-20)37-22(15)14-23-32-25-21(36-23)9-8-19(30-5)24(25)28(34)35/h6-9,12,15-18,22,27,30-31H,10-11,13-14H2,1-5H3,(H,34,35)/t15-,16-,17-,18-,22-,27+,29+/m1/s1
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4-(4-氟苯酚)-2-嘧啶CAS号 : 155957-43-0 Compound CID : 1474642分子式: C10H7FN2S 分子量: 206.243IUPAC Name: 6-(4-fluorophenyl)-1H-pyrimidine-2-thioneSMILES: C1=CC(=CC=C1C2=CC=NC(=S)N2)FInChIKey: IKNROSDVLWITKJ-UHFFFAOYSA-NInChI: InChI=1S/C10H7FN2S/c11-8-3-1-7(2-4-8)9-5-6-12-10(14)13-9/h1-6H,(H,12,13,14)
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2-氨基-4-(2-萘基)噻唑CAS号 : 21331-43-1 Compound CID : 673702分子式: C13H10N2S 分子量: 226.302IUPAC Name: 4-naphthalen-2-yl-1,3-thiazol-2-amineSMILES: C1=CC=C2C=C(C=CC2=C1)C3=CSC(=N3)NInChIKey: GWDNDNTTXIIXRS-UHFFFAOYSA-NInChI: InChI=1S/C13H10N2S/c14-13-15-12(8-16-13)11-6-5-9-3-1-2-4-10(9)7-11/h1-8H,(H2,14,15)
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缬苯那嗪CAS号 : 1025504-45-3 Compound CID : 24795069分子式: C24H38N2O4 分子量: 418.57IUPAC Name: [(2R,3R,11bR)-9,10-dimethoxy-3-(2-methylpropyl)-2,3,4,6,7,11b-hexahydro-1H-benzo[a]quinolizin-2-yl] (2S)-2-amino-3-methylbutanoateSMILES: CC(C)CC1CN2CCC3=CC(=C(C=C3C2CC1OC(=O)C(C(C)C)N)OC)OCInChIKey: GEJDGVNQKABXKG-CFKGEZKQSA-NInChI: InChI=1S/C24H38N2O4/c1-14(2)9-17-13-26-8-7-16-10-21(28-5)22(29-6)11-18(16)19(26)12-20(17)30-24(27)23(25)15(3)4/h10-11,14-15,17,19-20,23H,7-9,12-13,25H2,1-6H3/t17-,19-,20-,23+/m1/s1