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CAS No.	英文名/中文名/SMILES	分子式	分子量
-	(2S,4aR,6aS,6aS,6bR,8aS,10S,12aR,14bS)-10-hydroxy-2-methoxy-2,6a,6b,9,9,12a-hexamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylic acid - C[C@@]1(CC[C@@]2(CC[C@@]3(C(=CC[C@@H]4[C@]3(CC[C@H]5[C@@]4(CC[C@@H](C5(C)C)O)C)C)[C@@H]2C1)C)C(=O)O)OC	C₃₀H₄₈O₄	472.7
-	(1S,2R,5R,6S,7S)-6-N-(4-chlorophenyl)-2-N-[(1S,2R,3R)-2,3-dimethylcyclohexyl]-3-(3-morpholin-4-ylpropyl)-4-oxo-10-oxa-3-azatricyclo[5.2.1.01,5]dec-8-ene-2,6-dicarboxamide - C[C@@H]1CCC[C@@H]([C@@H]1C)NC(=O)[C@H]2[C@@]34C=C[C@H](O3)[C@H]([C@H]4C(=O)N2CCCN5CCOCC5)C(=O)NC6=CC=C(C=C6)Cl	C₃₁H₄₁ClN₄O₅	585.1
-	(1R,2R,4S,5'R,6R,7S,8S,9S,12R,13S,16R,18S)-5',7,9,13-tetramethylspiro[5-oxapentacyclo[10.8.0.02,9.04,8.013,18]icosane-6,2'-oxane]-16-ol - C[C@@H]1CC[C@@]2([C@H]([C@@H]3[C@@H](O2)C[C@H]4[C@@]3(CC[C@@H]5[C@H]4CC[C@@H]6[C@@]5(CC[C@H](C6)O)C)C)C)OC1	C₂₇H₄₄O₃	416.6
-	(3R,7S,8S,10R,15R,17R)-2,7-dihydroxy-8,10,17-trimethyl-6,14,18-trioxa-5-azapentacyclo[10.5.2.14,7.03,15.015,19]icosa-4,12(19)-diene-11,13-dione - C[C@@H]1C[C@@H]([C@@]2(CC(=NO2)[C@@H]3C(C4[C@@H](C[C@]35C(=C(C1=O)C(=O)O5)O4)C)O)O)C	C₁₉H₂₃NO₇	377.4
-	(4R)-4-(1,3-benzodioxol-5-yl)-8-methyl-3,11-dioxatetracyclo[8.7.0.02,7.013,17]heptadeca-1(10),2(7),8,13(17)-tetraene-6,12-dione - CC1=CC2=C(C3=C(CCC3)C(=O)O2)C4=C1C(=O)C[C@@H](O4)C5=CC6=C(C=C5)OCO6	C₂₃H₁₈O₆	390.4
-	4-[2-(2,4-Dihydroxyphenyl)ethyl]benzene-1,3-diol - C1=CC(=C(C=C1O)O)CCC2=C(C=C(C=C2)O)O	C₁₄H₁₄O₄	246.26
-	N-(9,10-dimethoxy-4-oxo-6,7-dihydropyrimido[6,1-a]isoquinolin-2-yl)-N-[(3R)-3-(furan-2-yl)-3-(4-methylphenyl)propyl]acetamide - CC1=CC=C(C=C1)[C@@H](CCN(C2=NC(=O)N3CCC4=CC(=C(C=C4C3=C2)OC)OC)C(=O)C)C5=CC=CO5	C₃₀H₃₁N₃O₅	513.6
-	[(1R,2S,4R,9R,10S,13S,16S,18R,19S)-18-hydroxy-5,5,9-trimethyl-14-oxo-15,17-dioxapentacyclo[11.5.1.01,10.04,9.016,19]nonadecan-2-yl] butanoate - CCCC(=O)O[C@H]1C[C@H]2[C@@](CCCC2(C)C)([C@H]3[C@@]14[C@@H]5[C@H](CC3)C(=O)O[C@@H]5O[C@H]4O)C	C₂₄H₃₆O₆	420.5
-	(1S,2S,5R,6S,7S)-2-N-cyclohexyl-3-[3-(4-ethylpiperazin-1-yl)propyl]-4-oxo-6-N-(4-phenoxyphenyl)-10-oxa-3-azatricyclo[5.2.1.01,5]dec-8-ene-2,6-dicarboxamide - CCN1CCN(CC1)CCCN2[C@@H]([C@@]34C=C[C@H](O3)[C@H]([C@H]4C2=O)C(=O)NC5=CC=C(C=C5)OC6=CC=CC=C6)C(=O)NC7CCCCC7	C₃₇H₄₇N₅O₅	641.8
-	(6R)-6,9,10-trihydroxy-8-methoxy-1-oxo-3-[(E)-prop-1-enyl]-6H-pyrano[4,3-c]isochromene-7-carboxylic acid - C/C=C/C1=CC2=C(C3=C([C@@H](O2)O)C(=C(C(=C3O)O)OC)C(=O)O)C(=O)O1	C₁₇H₁₄O₉	362.3