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CAS No.	英文名/中文名/SMILES	分子式	分子量
-	[(1S,3R,4S,7R,9R,10R,11S,13R)-4,9,13-trimethyl-5-oxo-6,14-dioxatetracyclo[8.4.0.01,13.03,7]tetradecan-11-yl] (Z)-2-methylbut-2-enoate - C/C=C(/C)\C(=O)O[C@H]1C[C@@]2([C@]3([C@@H]1[C@@H](C[C@@H]4[C@H](C3)[C@@H](C(=O)O4)C)C)O2)C	C₂₀H₂₈O₅	348.4
-	(2S)-N-[(3R,8S,9aS)-3-[(4-hydroxyphenyl)methyl]-1,4-dioxo-3,6,7,8,9,9a-hexahydro-2H-pyrido[1,2-a]pyrazin-8-yl]-2-hydroxy-2-phenylacetamide - C1CN2[C@@H](C[C@H]1NC(=O)[C@H](C3=CC=CC=C3)O)C(=O)N[C@@H](C2=O)CC4=CC=C(C=C4)O	C₂₃H₂₅N₃O₅	423.5
89-59-8	Benzene, 4-chloro-1-methyl-2-nitro- - CC1=C(C=C(C=C1)Cl)[N+](=O)[O-]	C₇H₆ClNO₂	171.58
-	(1R,8R,15R,19S)-17-(2-chlorophenyl)-4-ethyl-17-azapentacyclo[6.6.5.02,7.09,14.015,19]nonadeca-2(7),3,5,9,11,13-hexaene-16,18-dione - CCC1=CC2=C(C=C1)[C@@H]3[C@H]4[C@@H]([C@@H]2C5=CC=CC=C35)C(=O)N(C4=O)C6=CC=CC=C6Cl	C₂₆H₂₀ClNO₂	413.9
-	2-[(4-methyl-2-oxo-2H-chromen-7-yl)oxy]-N-{[1-(2-methylpropyl)-1H-benzimidazol-2-yl]methyl}acetamide - CC1=CC(=O)OC2=C1C=CC(=C2)OCC(=O)NCC3=NC4=CC=CC=C4N3CC(C)C	C₂₄H₂₅N₃O₄	419.5
-	1-[(1R,2R,5S)-1-hydroxy-2-methyl-5-propan-2-ylcyclohexyl]ethanone - C[C@@H]1CC[C@@H](C[C@@]1(C(=O)C)O)C(C)C	C₁₂H₂₂O₂	198.30
-	[(1R)-3-ethoxy-1-methoxypropyl]benzene - CCOCC[C@H](C1=CC=CC=C1)OC	C₁₂H₁₈O₂	194.27
-	(2S)-4-[(2S)-9-[(2S,5S)-5-[(1S,4R)-1,4-dihydroxy-4-[(2R,5R)-5-[(1R)-1-hydroxyundecyl]oxolan-2-yl]butyl]oxolan-2-yl]-2-hydroxynonyl]-2-methyl-2H-furan-5-one - CCCCCCCCCC[C@H]([C@H]1CC[C@@H](O1)[C@@H](CC[C@@H]([C@@H]2CC[C@@H](O2)CCCCCCC[C@@H](CC3=C[C@@H](OC3=O)C)O)O)O)O	C₃₇H₆₆O₈	638.9
-	(2,7-Dihydroxy-10-methoxy-1,5,9,12,12-pentamethyl-8-oxo-4-tetracyclo[7.6.0.03,7.011,13]pentadecanyl) 3-phenylprop-2-enoate - CC1CC2(C(C1OC(=O)C=CC3=CC=CC=C3)C(C4(CCC5C(C5(C)C)C(C4(C2=O)C)OC)C)O)O	C₃₀H₄₀O₆	496.6
-	1'-(cyclopropylmethyl)-2,4-dimethylspiro[6H-pyrazolo[1,5-a]pyrimidine-7,4'-piperidine]-5-one - CC1=NN2C(=C1)N(C(=O)CC23CCN(CC3)CC4CC4)C	C₁₆H₂₄N₄O	288.39