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CAS No.	英文名/中文名/SMILES	分子式	分子量
-	(3R,3'R,4R,5R,5'S,10R,13S,14R,17S)-3-[(2S,3R,4R,5R,6R)-6-[[(2S,3S,4S,5R)-3-[(2S,3R,4R,5S,6R)-3-[(2S,3S,4S)-3,4-dihydroxy-4-(hydroxymethyl)oxolan-2-yl]oxy-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4,5-dihydroxyoxan-2-yl]oxymethyl]-3,4,5-trihydroxyoxan-2-yl]oxy-4-(hydroxymethyl)-3',4,5',10,13,14-hexamethyl-5'-propanoylspiro[2,3,5,6,7,11,12,16-octahydro-1H-cyclopenta[a]phenanthrene-17,2'-oxolane]-15-one - CCC(=O)[C@@]1(C[C@H]([C@@]2(O1)CC(=O)[C@]3([C@@]2(CCC4=C3CC[C@@H]5[C@]4(CC[C@H]([C@@]5(C)CO)O[C@@H]6[C@@H]([C@@H]([C@H]([C@H](O6)CO[C@H]7[C@H]([C@H]([C@@H](CO7)O)O)O[C@H]8[C@@H]([C@@H]([C@@H]([C@H](O8)CO)O)O)O[C@H]9[C@H]([C@@](CO9)(CO)O)O)O)O)O)C)C)C)C)C	C₅₂H₈₂O₂₃	1075.2
3829-79-6	Deca-2,8-diene-4,6-diyne-1,10-diol - C(C=CC#CC#CC=CCO)O	C₁₀H₁₀O₂	162.18
-	(5S)-5-[4-[(5S)-5-methoxy-3-oxo-2-[(Z)-pent-2-enyl]cyclopenten-1-yl]butyl]oxolan-2-one - CC/C=C\CC1=C([C@H](CC1=O)OC)CCCC[C@H]2CCC(=O)O2	C₁₉H₂₈O₄	320.4
-	6-ethyl-7-hydroxy-2-methyl-3-(1-methylbenzimidazol-2-yl)-8-[[(3S)-3-methylpiperidin-1-yl]methyl]chromen-4-one - CCC1=CC2=C(C(=C1O)CN3CCC[C@@H](C3)C)OC(=C(C2=O)C4=NC5=CC=CC=C5N4C)C	C₂₇H₃₁N₃O₃	445.6
-	11-hydroxy-8a-(hydroxymethyl)-4,4a,6a,6b,11,14a-hexamethyl-2,4,5,6,6a,7,8,9,10,12,12a,13,14,14b-tetradecahydro-1H-picen-3-one - CC1C(=O)CCC2C1(CCC3C2(CCC4(C3(CCC5(C4CC(CC5)(C)O)CO)C)C)C)C	C₂₉H₄₈O₃	444.7
-	9-(3-Hydroxyphenyl)-2-[(2,4,5-trimethoxyphenyl)methylidene]-8,9-dihydrofuro[2,3-f]chromene-3,7-dione - COC1=CC(=C(C=C1C=C2C(=O)C3=C(O2)C4=C(C=C3)OC(=O)CC4C5=CC(=CC=C5)O)OC)OC	C₂₇H₂₂O₈	474.5
-	9-(4-Hydroxyphenyl)-2-[(3,4,5-trimethoxyphenyl)methylidene]-8,9-dihydrofuro[2,3-f]chromene-3,7-dione - COC1=CC(=CC(=C1OC)OC)C=C2C(=O)C3=C(O2)C4=C(C=C3)OC(=O)CC4C5=CC=C(C=C5)O	C₂₇H₂₂O₈	474.5
-	(2S,8'R)-7-chloro-4,6-dimethoxy-5'-(7-methoxy-1-methyl-2-oxoquinolin-3-yl)-1',3',8'-trimethylspiro[1-benzofuran-2,7'-5,8,9,10-tetrahydropyrimido[4,5-b]quinoline]-2',3,4',6'-tetrone - C[C@@H]1CC2=C(C(C3=C(N2)N(C(=O)N(C3=O)C)C)C4=CC5=C(C=C(C=C5)OC)N(C4=O)C)C(=O)[C@]16C(=O)C7=C(O6)C(=C(C=C7OC)OC)Cl	C₃₄H₃₁ClN₄O₉	675.1
-	(1S,11S)-12-(1-acetylpiperidin-4-yl)-9-methyl-2-oxa-9,12-diazatricyclo[9.2.1.03,8]tetradeca-3,5,7-trien-10-one - CC(=O)N1CCC(CC1)N2C[C@@H]3C[C@H]2C(=O)N(C4=CC=CC=C4O3)C	C₁₉H₂₅N₃O₃	343.4
-	3-[(2R)-1-[3-(3-phenoxyphenoxy)propyl]piperidin-2-yl]pyridine - C1CCN([C@H](C1)C2=CN=CC=C2)CCCOC3=CC(=CC=C3)OC4=CC=CC=C4	C₂₅H₂₈N₂O₂	388.5