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CAS No.	英文名/中文名/SMILES	分子式	分子量
101769-87-3	Isopilocarpic Acid Sodium Salt Isopilocarpic Acid Sodium Salt CCC(C(CC1=CN=CN1C)CO)C(=O)[O-].[Na+]	C₁₁H₁₇N₂NAO₃	248.25
38002-18-5	6-Oxo-ethinylestradiol 6-Keto Ethynyl Estradiol CC12CCC3C(C1CCC2(C#C)O)CC(=O)C4=C3C=CC(=C4)O	C₂₀H₂₂O₃	310.4
66635-92-5	(S)-Ketorolac (1s)-5-苯基-2,3-二氢-1H-吡啶-1-羧酸 C1CN2C(=CC=C2C(=O)C3=CC=CC=C3)C1C(=O)O	C₁₅H₁₃NO₃	255.27
49625-89-0	6beta-Naltrexol 6β-Naltrexol (1.0 mg/mL in Methanol) C1CC1CN2CCC34C5C(CCC3(C2CC6=C4C(=C(C=C6)O)O5)O)O	C₂₀H₂₅NO₄	343.4
41639-83-2	Latanoprost acid 拉坦前列腺素(游离酸) C1C(C(C(C1O)CC=CCCCC(=O)O)CCC(CCC2=CC=CC=C2)O)O	C₂₃H₃₄O₅	390.5
177472-30-9	Ethyl 9-fluoro-3-methyl-10-(4-methylpiperazin-1-yl)-7-oxo-3,7-dihydro-2H-[1,4]oxazino[2,3,4-ij]quinoline-6-carboxylate 左氧氟沙星乙酯 CCOC(=O)C1=CN2C(COC3=C2C(=CC(=C3N4CCN(CC4)C)F)C1=O)C	C₂₀H₂₄FN₃O₄	389.4
56718-70-8	2-((4-(2-Methoxyethyl)phenoxy)methyl)oxirane 3-[4-(2-Methoxyethyl)phenoxy]-1,2-epoxypropane COCCC1=CC=C(C=C1)OCC2CO2	C₁₂H₁₆O₃	208.25
128940-83-0	(3R,4S,5S,6R,7R,9R,11R,12R,13S,14R)-6-[(2S,3R,4S,6R)-4-(Dimethylamino)-3-hydroxy-6-methyloxan-2-yl]oxy-14-ethyl-12-hydroxy-4-[(2R,4R,5S,6S)-5-hydroxy-4-methoxy-4,6-dimethyloxan-2-yl]oxy-7,13-dimethoxy-3,5,7,9,11,13-hexamethyl-oxacyclotetradecane-2,10-dione 12-O-Methyl Clarithromycin CCC1C(C(C(C(=O)C(CC(C(C(C(C(C(=O)O1)C)OC2CC(C(C(O2)C)O)(C)OC)C)OC3C(C(CC(O3)C)N(C)C)O)(C)OC)C)C)O)(C)OC	C₃₉H₇₁NO₁₃	762.0
85933-19-3	2-Hydrazinyl-3-(4-hydroxy-3-methoxyphenyl)-2-methylpropanoic acid 卡比多巴相关物质A CC(CC1=CC(=C(C=C1)O)OC)(C(=O)O)NN	C₁₁H₁₆N₂O₄	240.26
1076198-52-1	6,6'-Methylenebis((3RS)-9-methyl-3-((2-methyl-1H-imidazol-1-yl)methyl)-1,2,3,9-tetrahydro-4H-carbazol-4-one) 盐酸昂丹司琼杂质B(EP) CC1=NC=CN1CC2CCC3=C(C2=O)C4=C(N3C)C=CC(=C4)CC5=CC6=C(C=C5)N(C7=C6C(=O)C(CC7)CN8C=CN=C8C)C	C₃₇H₃₈N₆O₂	598.7