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CAS No.	英文名/中文名/SMILES	分子式	分子量
-	2-(3-Hydroxy-4-methylphenyl)-5-methyl-4-hexen-3-one - CC1=C(C=C(C=C1)C(C)C(=O)C=C(C)C)O	C₁₄H₁₈O₂	218.29
-	(7R)-2,7-dimethyl-6,7,8,9-tetrahydropyrido[2,3-g]quinoline - C[C@@H]1CCC2=C(N1)C=C3C=CC(=NC3=C2)C	C₁₄H₁₆N₂	212.29
-	(4aR,7R,8S,8aS)-8-[2-(furan-3-yl)ethyl]-4,4a,7,8-tetramethyl-5,6,7,8a-tetrahydro-1H-naphthalen-2-one - C[C@@H]1CC[C@@]2([C@H]([C@@]1(C)CCC3=COC=C3)CC(=O)C=C2C)C	C₂₀H₂₈O₂	300.4
-	(1S,2R,4R,8S,9R,12S,13S,16S)-2,8,12-trihydroxy-5,5-dimethyl-18-methylidene-11-oxapentacyclo[11.3.2.01,12.04,9.09,16]octadecan-17-one - CC1(CC[C@@H]([C@]23[C@@H]1C[C@H]([C@]45[C@H]2CC[C@H]([C@@]4(OC3)O)C(=C)C5=O)O)O)C	C₂₀H₂₈O₅	348.4
-	3-[(2S,5aS,8aR)-6-[(4-hydroxyphenyl)methyl]-1-methyl-5-oxo-3,4,5a,7,8,8a-hexahydro-2H-pyrrolo[3,2-e][1,4]diazepin-2-yl]-N,N-diethylpropanamide - CCN(CC)C(=O)CC[C@H]1CNC(=O)[C@@H]2[C@H](N1C)CCN2CC3=CC=C(C=C3)O	C₂₂H₃₄N₄O₃	402.5
-	Penitalarin B - C[C@@H](CCO)/C=C/C=C(\C)/C[C@@H](C)/C=C/C=C/[C@H]1[C@@]2([C@@H](O2)[C@@H](O1)C(=O)OC)C	C₂₃H₃₄O₅	390.5
-	1'-methyl-N-(4-methylcyclohexyl)-9'-oxo-8',9'-dihydrospiro[cyclohexane-1,7'-furo[3,2-f]chromene]-2'-carboxamide - CC1CCC(CC1)NC(=O)C2=C(C3=C(O2)C=CC4=C3C(=O)CC5(O4)CCCCC5)C	C₂₅H₃₁NO₄	409.5
-	[6-[[(3aS,7R,7aS)-7-hydroxy-5-methyl-4-oxo-3a,6,7,7a-tetrahydro-1H-imidazo[4,5-c]pyridin-2-yl]amino]-5-[(2-aminoacetyl)-methylamino]-3,4-dihydroxyoxan-2-yl]methyl carbamate - CN1C[C@H]([C@@H]2[C@@H](C1=O)N=C(N2)NC3C(C(C(C(O3)COC(=O)N)O)O)N(C)C(=O)CN)O	C₁₇H₂₉N₇O₈	459.5
-	1-[(1S,4S)-4-[1-(4-tert-butylphenyl)-3,5-dimethylpyrazol-4-yl]cyclopent-2-en-1-yl]-3-(4-methoxyphenyl)urea - CC1=C(C(=NN1C2=CC=C(C=C2)C(C)(C)C)C)[C@H]3C[C@@H](C=C3)NC(=O)NC4=CC=C(C=C4)OC	C₂₈H₃₄N₄O₂	458.6
-	N-[2-[3,5-dibromo-4-[3-(dimethylamino)propoxy]phenyl]ethyl]-3-(3,5-dibromo-4-methoxyphenyl)prop-2-enamide - CN(C)CCCOC1=C(C=C(C=C1Br)CCNC(=O)C=CC2=CC(=C(C(=C2)Br)OC)Br)Br	C₂₃H₂₆BR₄N₂O₃	698.1