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CAS No.	英文名/中文名/SMILES	分子式	分子量
-	5-(4-chlorobenzyl)-1,3-dimethyl-5-{[(1R,5S)-8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocin-3(4H)-yl]methyl}pyrimidine-2,4,6(1H,3H,5H)-trione - CN1C(=O)C(C(=O)N(C1=O)C)(CC2=CC=C(C=C2)Cl)CN3C[C@@H]4C[C@H](C3)C5=CC=CC(=O)N5C4	C₂₅H₂₇ClN₄O₄	483.0
-	(3aR,5R,6S,6aR)-5-(2,2-dimethyl-1,3-dioxolan-4-yl)-6-[(4-ethoxyphenyl)methoxy]-2,2-dimethyl-3a,5,6,6a-tetrahydrofuro[2,3-d][1,3]dioxole - CCOC1=CC=C(C=C1)CO[C@@H]2[C@@H]3[C@H](O[C@@H]2C4COC(O4)(C)C)OC(O3)(C)C	C₂₁H₃₀O₇	394.5
-	1-[(1R,2S,9R,10R)-3,15-diazatetracyclo[7.7.1.02,7.010,15]heptadec-7-en-3-yl]-3-(2,3-dihydro-1-benzofuran-5-yl)propan-1-one - C1CCN2C[C@H]3C[C@@H]([C@H]2C1)C=C4[C@H]3N(CCC4)C(=O)CCC5=CC6=C(C=C5)OCC6	C₂₆H₃₄N₂O₂	406.6
-	(8S)-6-(3-imidazol-1-ylpropyl)-2-phenyl-3,6,17-triazatetracyclo[8.7.0.03,8.011,16]heptadeca-1(10),11,13,15-tetraene-4,7-dione - C1[C@H]2C(=O)N(CC(=O)N2C(C3=C1C4=CC=CC=C4N3)C5=CC=CC=C5)CCCN6C=CN=C6	C₂₆H₂₅N₅O₂	439.5
-	2-[(1R)-1-(1,3-benzodioxol-5-yl)-4a-hydroxy-1,3,4,5,6,7,8,8a-octahydroisoquinolin-2-yl]-N-butylacetamide - CCCCNC(=O)CN1CCC2(CCCCC2[C@@H]1C3=CC4=C(C=C3)OCO4)O	C₂₂H₃₂N₂O₄	388.5
-	5-(((6-Methyl-4-oxo-1,2,3,4-tetrahydrocyclopenta[c]chromen-7-yl)oxy)methyl)furan-2-carboxylic acid - CC1=C(C=CC2=C1OC(=O)C3=C2CCC3)OCC4=CC=C(O4)C(=O)O	C₁₉H₁₆O₆	340.3
-	N~2~-[(2S)-2-(1-methyl-2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl)-3-phenylpropanoyl]-L-glutamine - CN1C2=CC=CC=C2C(=O)N(C1=O)[C@@H](CC3=CC=CC=C3)C(=O)N[C@@H](CCC(=O)N)C(=O)O	C₂₃H₂₄N₄O₆	452.5
-	[(3S,5R,8R,10S,13R,14S,17R)-14-hydroxy-10,13-dimethyl-17-(5-oxo-2H-furan-3-yl)-1,2,3,4,5,6,7,8,9,11,12,15,16,17-tetradecahydrocyclopenta[a]phenanthren-3-yl] 2-[(1R,9R,13S,14R)-13-ethyl-14,18-dihydroxy-8-methyl-8-aza-15-azoniahexacyclo[14.2.1.01,9.02,7.010,15.012,17]nonadeca-2,4,6-trien-15-yl]acetate;bromide - CC[C@@H]1[C@H]([N+]2(C3CC1C4C2C[C@@]5([C@H]3N(C6=CC=CC=C65)C)C4O)CC(=O)O[C@H]7CC[C@]8([C@@H](C7)CC[C@@H]9C8CC[C@]1([C@@]9(CC[C@@H]1C1=CC(=O)OC1)O)C)C)O.[Br-]	C₄₅H₆₁BRN₂O₇	821.9
-	4-hydroxy-3-[4-hydroxy-2-(2-phenylethyl)pyrido[2,3-d]pyrimidin-7-yl]-6-methyl-2H-pyran-2-one - CC1=CC(=C(C(=O)O1)C2=NC3=C(C=C2)C(=O)NC(=N3)CCC4=CC=CC=C4)O	C₂₁H₁₇N₃O₄	375.4
-	7-(3,7-Dimethylocta-2,6-dienoxy)-3-quinolin-2-ylchromen-2-one - CC(=CCCC(=CCOC1=CC2=C(C=C1)C=C(C(=O)O2)C3=NC4=CC=CC=C4C=C3)C)C	C₂₈H₂₇NO₃	425.5