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CAS No.	英文名/中文名/SMILES	分子式	分子量
82863-65-8	Cyclo(Tyr-Leu) Cyclo(Tyr-Leu) CC(C)CC1C(=O)NC(C(=O)N1)CC2=CC=C(C=C2)O	C₁₅H₂₀N₂O₃	276.33
83199-38-6	Angelol G Angelol G CC=C(C)C(=O)OC(C1=C(C=C2C(=C1)C=CC(=O)O2)OC)C(C(C)(C)O)O	C₂₀H₂₄O₇	376.4
89354-01-8	[(2S,3R,4S,5S,6R)-6-[[(2R,3R,4R,5S,6R)-3,4-dihydroxy-6-(hydroxymethyl)-5-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]oxymethyl]-3,4,5-trihydroxyoxan-2-yl] (1R,2R,5S,8R,10R,16R,17S,18S)-16-hydroxy-1,2,17-trimethyl-14-oxo-8,18-bis(prop-1-en-2-yl)-13-oxapentacyclo[10.8.1.02,10.05,9.017,21]henicosane-5-carboxylate Chiisanoside CC1C(C(C(C(O1)OC2C(OC(C(C2O)O)OCC3C(C(C(C(O3)OC(=O)C45CCC(C4C6CC7C8C(C6(CC5)C)(CCC(C8(C(CC(=O)O7)O)C)C(=C)C)C)C(=C)C)O)O)O)CO)O)O)O	C₄₈H₇₄O₁₉	955.1
89808-50-4	(2S,4aR,6aR,6aS,6bR,8aR,9R,10R,11S,12aR,14bS)-11-hydroxy-9-(hydroxymethyl)-2-methoxycarbonyl-2,6a,6b,9,12a-pentamethyl-10-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylic acid 商陆皂苷 D CC1(CCC2(CCC3(C(=CCC4C3(CCC5C4(CC(C(C5(C)CO)OC6C(C(C(C(O6)CO)O)O)O)O)C)C)C2C1)C)C(=O)O)C(=O)OC	C₃₇H₅₈O₁₂	694.8
917482-67-8	Platycoside M1 Platycoside M1 CC1(CCC2(C(C1)C3=CCC4C(C3(CC2O)C)(CCC5C4(CC6C(C5(C(=O)O6)CO)OC7C(C(C(C(O7)CO)O)O)O)C)C)C(=O)O)C	C₃₆H₅₄O₁₂	678.8
933054-33-2	CID 95224420 Monomethyl lithospermate COC(=O)C1C(OC2=C(C=CC(=C12)C=CC(=O)OC(CC3=CC(=C(C=C3)O)O)C(=O)O)O)C4=CC(=C(C=C4)O)O	C₂₈H₂₄O₁₂	552.5
96685-01-7	CID 131676066 rabdoserrin A CC12CCC(C34C1CC(C56C3CCC(C5O)C(=C)C6=O)OC4OC2)O	C₂₀H₂₆O₅	346.4
100986-86-5	D-Ofloxacin 左氧氟沙星杂质E CC1COC2=C3N1C=C(C(=O)C3=CC(=C2N4CCN(CC4)C)F)C(=O)O	C₁₈H₂₀FN₃O₄	361.4
1029364-73-5	6,8-Dimethoxymoxifloxacin 6,8-Dimethoxymoxifloxacin COC1=C(C(=C2C(=C1)C(=O)C(=CN2C3CC3)C(=O)O)OC)N4CC5CCCNC5C4	C₂₂H₂₇N₃O₅	413.5
1029364-75-7	8-Ethoxymoxifloxacin 8-Ethoxymoxifloxacin CCOC1=C2C(=CC(=C1N3CC4CCCNC4C3)F)C(=O)C(=CN2C5CC5)C(=O)O	C₂₂H₂₆FN₃O₄	415.5