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HIV整合酶
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度鲁特韦 (GSK1349572)CAS号: 1051375-16-6分子式: C20H19F2N3O5 分子量: 419.38IUPAC Name: (3S,7R)-N-[(2,4-difluorophenyl)methyl]-11-hydroxy-7-methyl-9,12-dioxo-4-oxa-1,8-diazatricyclo[8.4.0.03,8]tetradeca-10,13-diene-13-carboxamideSMILES: CC1CCOC2N1C(=O)C3=C(C(=O)C(=CN3C2)C(=O)NCC4=C(C=C(C=C4)F)F)OInChIKey: RHWKPHLQXYSBKR-BMIGLBTASA-NInChI: 1S/C20H19F2N3O5/c1-10-4-5-30-15-9-24-8-13(17(26)18(27)16(24)20(29)25(10)15)19(28)23-7-11-2-3-12(21)6-14(11)22/h2-3,6,8,10,15,27H,4-5,7,9H2,1H3,(H,23,28)/t10-,15+/m1/s1
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洋槐黄素(Robinetin)分子式: C15H10O7 分子量: 302.24IUPAC Name: 3,7-dihydroxy-2-(3,4,5-trihydroxyphenyl)chromen-4-oneSMILES: C1=CC2=C(C=C1O)OC(=C(C2=O)O)C3=CC(=C(C(=C3)O)O)OInChIKey: SOEDEYVDCDYMMH-UHFFFAOYSA-NInChI: 1S/C15H10O7/c16-7-1-2-8-11(5-7)22-15(14(21)12(8)19)6-3-9(17)13(20)10(18)4-6/h1-5,16-18,20-21H
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BI 224436CAS号: 1155419-89-8 Compound CID : 66561902分子式: C27H26N2O4 分子量: 442.51IUPAC Name: (2S)-2-[2-methyl-4-(2-oxa-8-azatricyclo[7.3.1.05,13]trideca-1(13),5,7,9,11-pentaen-10-yl)quinolin-3-yl]-2-[(2-methylpropan-2-yl)oxy]acetic acidSMILES: CC1=NC2=CC=CC=C2C(=C1C(C(=O)O)OC(C)(C)C)C3=C4C5=C(C=C3)OCCC5=CC=N4InChIKey: MIXIIJCBELCMCZ-VWLOTQADSA-NInChI: 1S/C27H26N2O4/c1-15-21(25(26(30)31)33-27(2,3)4)23(17-7-5-6-8-19(17)29-15)18-9-10-20-22-16(12-14-32-20)11-13-28-24(18)22/h5-11,13,25H,12,14H2,1-4H3,(H,30,31)/t25-/m0/s1
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HIV-1 integrase inhibitor 8CAS号: 1568-80-5分子式: C21H24O2 分子量: 308.42IUPAC Name: 1,1,1',1'-tetramethyl-3,3'-spirobi[2H-indene]-5,5'-diolSMILES: CC1(CC2(CC(C3=C2C=C(C=C3)O)(C)C)C4=C1C=CC(=C4)O)CInChIKey: SICLLPHPVFCNTJ-UHFFFAOYSA-NInChI: 1S/C21H24O2/c1-19(2)11-21(17-9-13(22)5-7-15(17)19)12-20(3,4)16-8-6-14(23)10-18(16)21/h5-10,22-23H,11-12H2,1-4H3
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Cabotegravir sodium分子式: C19H16F2N3NaO5 分子量: 427.33IUPAC Name: sodium;(3R,6S)-12-[(2,4-difluorophenyl)methylcarbamoyl]-6-methyl-8,11-dioxo-4-oxa-1,7-diazatricyclo[7.4.0.03,7]trideca-9,12-dien-10-olateSMILES: CC1COC2N1C(=O)C3=C(C(=O)C(=CN3C2)C(=O)NCC4=C(C=C(C=C4)F)F)[O-].[Na+]InChIKey: AEZBWGMXBKPGFP-KIUAEZIZSA-MInChI: 1S/C19H17F2N3O5.Na/c1-9-8-29-14-7-23-6-12(16(25)17(26)15(23)19(28)24(9)14)18(27)22-5-10-2-3-11(20)4-13(10)21;/h2-4,6,9,14,26H,5,7-8H2,1H3,(H,22,27);/q;+1/p-1/t9-,14+;/m0./s1
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XZ426CAS号: 1638504-52-5分子式: C22H24F2N4O4 分子量: 446.45SMILES: O=C(C1=C(N)C2=C(N=CC(CCCCCCO)=C2)N(O)C1=O)NCC3=CC=C(C=C3F)F
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HIV-1 integrase inhibitorCAS号: 544467-07-4分子式: C11H9N3O4 分子量: 247.21SMILES: OC(/C(O)=C/C(C1=CC=CC(CN=[N+]=[N-])=C1)=O)=O
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1,5-Naphthyridine-3-carboxamide, 7-((4-fluorophenyl)methyl)-1,2-dihydro-4-hydroxy-N-(2-hydroxyethyl)-1-methyl-2-oxo-CAS号: 863434-13-3 Compound CID : 54718859分子式: C19H18FN3O4 分子量: 371.4IUPAC Name: 7-[(4-fluorophenyl)methyl]-4-hydroxy-N-(2-hydroxyethyl)-1-methyl-2-oxo-1,5-naphthyridine-3-carboxamideSMILES: CN1C2=C(C(=C(C1=O)C(=O)NCCO)O)N=CC(=C2)CC3=CC=C(C=C3)FInChIKey: QWLNINWUBHHOLU-UHFFFAOYSA-NInChI: 1S/C19H18FN3O4/c1-23-14-9-12(8-11-2-4-13(20)5-3-11)10-22-16(14)17(25)15(19(23)27)18(26)21-6-7-24/h2-5,9-10,24-25H,6-8H2,1H3,(H,21,26)
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