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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2-甲基吡唑并[1,5-a]喹唑啉-5(4h)-酮CAS号 : 25468-50-2 Compound CID : 135512367分子式: C11H9N3O 分子量: 199.2IUPAC Name: 2-methyl-4H-pyrazolo[1,5-a]quinazolin-5-oneSMILES: CC1=NN2C3=CC=CC=C3C(=O)NC2=C1InChIKey: RFGCWJZOFBNOEK-UHFFFAOYSA-NInChI: InChI=1S/C11H9N3O/c1-7-6-10-12-11(15)8-4-2-3-5-9(8)14(10)13-7/h2-6H,1H3,(H,12,15)
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UCN-01,PKC抑制剂CAS号 : 112953-11-4 Compound CID : 72271分子式: C28H26N4O4 分子量: 482.53IUPAC Name: (2S,3R,4R,6R,18R)-18-hydroxy-3-methoxy-2-methyl-4-(methylamino)-29-oxa-1,7,17-triazaoctacyclo[12.12.2.12,6.07,28.08,13.015,19.020,27.021,26]nonacosa-8,10,12,14,19,21,23,25,27-nonaen-16-oneSMILES: CC12C(C(CC(O1)N3C4=CC=CC=C4C5=C6C(=C7C8=CC=CC=C8N2C7=C53)C(NC6=O)O)NC)OCInChIKey: PBCZSGKMGDDXIJ-HQCWYSJUSA-NInChI: InChI=1S/C28H26N4O4/c1-28-25(35-3)15(29-2)12-18(36-28)31-16-10-6-4-8-13(16)19-21-22(27(34)30-26(21)33)20-14-9-5-7-11-17(14)32(28)24(20)23(19)31/h4-11,15,18,25,27,29,34H,12H2,1-3H3,(H,30,33)/t15-,18-,25-,27-,28+/m1/s1
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5-氨基-1(2H)-异喹啉酮CAS号 : 93117-08-9 Compound CID : 2072分子式: C9H8N2O 分子量: 160.2IUPAC Name: 5-amino-2H-isoquinolin-1-oneSMILES: C1=CC2=C(C=CNC2=O)C(=C1)NInChIKey: SVASVGVAQIVSEZ-UHFFFAOYSA-NInChI: InChI=1S/C9H8N2O/c10-8-3-1-2-7-6(8)4-5-11-9(7)12/h1-5H,10H2,(H,11,12)
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2-甲基吡唑并[1,5-a]喹唑啉-5(4H)-酮CAS号 : 25468-50-2 Compound CID : 135512367分子式: C11H9N3O 分子量: 199.2IUPAC Name: 2-methyl-4H-pyrazolo[1,5-a]quinazolin-5-oneSMILES: CC1=NN2C3=CC=CC=C3C(=O)NC2=C1InChIKey: RFGCWJZOFBNOEK-UHFFFAOYSA-NInChI: InChI=1S/C11H9N3O/c1-7-6-10-12-11(15)8-4-2-3-5-9(8)14(10)13-7/h2-6H,1H3,(H,12,15)
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5-甲基-3,4-二氢异喹啉-1-酮CAS号 : 129075-56-5 Compound CID : 148140分子式: C10H11NO 分子量: 161.2IUPAC Name: 5-methyl-3,4-dihydro-2H-isoquinolin-1-oneSMILES: CC1=C2CCNC(=O)C2=CC=C1InChIKey: RLLZPXDJYADIEU-UHFFFAOYSA-NInChI: InChI=1S/C10H11NO/c1-7-3-2-4-9-8(7)5-6-11-10(9)12/h2-4H,5-6H2,1H3,(H,11,12)