化学生物学
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呋咯地辛CAS号 : 209799-67-7 Compound CID : 135409409分子式: C11H14N4O4 分子量: 266.2533IUPAC Name: 7-[(2S,3S,4R,5R)-3,4-dihydroxy-5-(hydroxymethyl)pyrrolidin-2-yl]-3,5-dihydropyrrolo[3,2-d]pyrimidin-4-oneSMILES: C1=C(C2=C(N1)C(=O)NC=N2)C3C(C(C(N3)CO)O)OInChIKey: IWKXDMQDITUYRK-KUBHLMPHSA-NInChI: InChI=1S/C11H14N4O4/c16-2-5-9(17)10(18)7(15-5)4-1-12-8-6(4)13-3-14-11(8)19/h1,3,5,7,9-10,12,15-18H,2H2,(H,13,14,19)/t5-,7+,9-,10+/m1/s1
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2,3-二羟基-5-异丙基环庚烷-2,4,6-三烯酮CAS号 : 29346-20-1 Compound CID : 72605分子式: C10H12O3 分子量: 180.203IUPAC Name: 2,3-dihydroxy-6-propan-2-ylcyclohepta-2,4,6-trien-1-oneSMILES: CC(C)C1=CC(=O)C(=C(C=C1)O)OInChIKey: HVGNSPLLPQWYGC-UHFFFAOYSA-NInChI: InChI=1S/C10H12O3/c1-6(2)7-3-4-8(11)10(13)9(12)5-7/h3-6H,1-2H3,(H2,11,12,13)
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Telotristat,色氨酸羟化酶抑制剂CAS号 : 1033805-22-9 Compound CID : 25181577分子式: C27H26ClF3N6O3 分子量: 574.99IUPAC Name: ethyl (2S)-2-amino-3-[4-[2-amino-6-[(1R)-1-[4-chloro-2-(3-methylpyrazol-1-yl)phenyl]-2,2,2-trifluoroethoxy]pyrimidin-4-yl]phenyl]propanoateSMILES: CCOC(=O)C(CC1=CC=C(C=C1)C2=CC(=NC(=N2)N)OC(C3=C(C=C(C=C3)Cl)N4C=CC(=N4)C)C(F)(F)F)NInChIKey: MDSQOJYHHZBZKA-GBXCKJPGSA-NInChI: InChI=1S/C27H26ClF3N6O3/c1-3-39-25(38)20(32)12-16-4-6-17(7-5-16)21-14-23(35-26(33)34-21)40-24(27(29,30)31)19-9-8-18(28)13-22(19)37-11-10-15(2)36-37/h4-11,13-14,20,24H,3,12,32H2,1-2H3,(H2,33,34,35)/t20-,24+/m0/s1