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CAS No.	英文名/中文名/SMILES	分子式	分子量
-	(1R,2S,6R)-11,11-dimethyl-5,10,12-trioxatricyclo[6.5.0.02,6]tridec-7-ene - CC1(OC[C@@H]2[C@@H]3CCO[C@H]3C=C2CO1)C	C₁₂H₁₈O₃	210.27
-	(5's,7's)-5',7'-Di(propan-2-yl)-1',3'-diazaspiro[cyclohexane-1,2'-tricyclo[3.3.1.1~3,7~]decan]-6'-one - CC(C)C12CN3CC(C1=O)(CN(C2)C34CCCCC4)C(C)C	C₁₉H₃₂N₂O	304.5
-	(1R,3S,5R,8Z,11S)-5,9-dimethyl-14-methylidene-4,12-dioxatricyclo[9.3.0.03,5]tetradec-8-en-13-one - C/C/1=C/CC[C@@]2([C@@H](O2)C[C@H]3[C@H](C1)OC(=O)C3=C)C	C₁₅H₂₀O₃	248.32
-	2-[(3S)-1-(quinolin-3-ylmethyl)pyrrolidin-3-yl]-1,3-benzothiazole - C1CN(C[C@H]1C2=NC3=CC=CC=C3S2)CC4=CC5=CC=CC=C5N=C4	C₂₁H₁₉N₃S	345.5
-	1-ethyl-4-hydroxy-3-[N-(4-methoxyphenyl)-C-methylcarbonimidoyl]quinolin-2-one - CCN1C2=CC=CC=C2C(=C(C1=O)C(=NC3=CC=C(C=C3)OC)C)O	C₂₀H₂₀N₂O₃	336.4
-	(2S,3R,4S,5S,6R)-2-[[(2R,3S,4S,5R,6S)-6-[[(1R,3R,4S)-4,10-dihydroxy-9-methoxy-1,3-dimethyl-3,4-dihydro-1H-benzo[g]isochromen-5-yl]oxy]-3,4,5-trihydroxyoxan-2-yl]methoxy]-6-(hydroxymethyl)oxane-3,4,5-triol - C[C@@H]1[C@H](C2=C(C3=C(C(=CC=C3)OC)C(=C2[C@H](O1)C)O)O[C@H]4[C@@H]([C@H]([C@@H]([C@H](O4)CO[C@@H]5[C@@H]([C@H]([C@@H]([C@H](O5)CO)O)O)O)O)O)O)O	C₂₈H₃₈O₁₅	614.6
-	1-[2,6-Dihydroxy-4-[(3-methyl-2-butenyl)oxy]phenyl]-2-methyl-1-propanone - CC(C)C(=O)C1=C(C=C(C=C1O)OCC=C(C)C)O	C₁₅H₂₀O₄	264.32
-	(4R,5R)-4-[(6aS,9aS)-4-amino-5,6,6a,7,8,9-hexahydrocyclopenta[f]isoquinolin-9a-yl]-1-(3,4-dihydroxy-5-methoxyphenyl)-5-hydroxy-7-(4-hydroxy-3-methoxyphenyl)heptan-3-one - COC1=CC(=CC(=C1O)O)CCC(=O)[C@@H]([C@@H](CCC2=CC(=C(C=C2)O)OC)O)[C@]34CCC[C@H]3CCC5=C4C=CN=C5N	C₃₃H₄₀N₂O₇	576.7
-	3-(5,11-dioxo-6a,11-dihydroisoindolo[2,1-a]quinazolin-6(5H)-yl)-N-(4H-1,2,4-triazol-3-yl)propanamide - C1=CC=C2C(=C1)C3N(C(=O)C4=CC=CC=C4N3C2=O)CCC(=O)NC5=NC=NN5	C₂₀H₁₆N₆O₃	388.4
-	2-aminoethyl (2S,4aR,6aS,6aS,6bR,8aR,10S,12aS)-10-hydroxy-2,4a,6a,6b,9,9,12a-heptamethyl-4-oxo-3,5,6,6a,7,8,8a,10,11,12-decahydro-1H-picene-2-carboxylate - C[C@]12CC[C@@H](C([C@@H]1CC[C@@]3([C@H]2C=CC4=C5C[C@](CC(=O)[C@@]5(CC[C@]43C)C)(C)C(=O)OCCN)C)(C)C)O	C₃₂H₄₉NO₄	511.7