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CAS No.	英文名/中文名/SMILES	分子式	分子量
-	(4aS,6aR,6aS,6bR,8aS,9R,10S,12aR,14bS)-9-(hydroxymethyl)-2,2,6a,6b,9,12a-hexamethyl-10-[(2S,3R,4S,5S)-3,4,5-trihydroxyoxan-2-yl]oxy-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylic acid - C[C@]12CC[C@@H]([C@@]([C@H]1CC[C@@]3([C@@H]2CC=C4[C@]3(CC[C@@]5([C@H]4CC(CC5)(C)C)C(=O)O)C)C)(C)CO)O[C@H]6[C@@H]([C@H]([C@H](CO6)O)O)O	C₃₅H₅₆O₈	604.8
-	(1S,9R,19S,22R)-22-chloro-20,20-dimethyl-2,12,16,18-tetrazahexacyclo[10.10.0.01,9.02,19.03,8.015,19]docosa-3,5,7,13,15-pentaene-11,17-dione - CC1(C[C@H]([C@]23[C@@H]4CC(=O)N2C=CC5=NC(=O)N[C@@]51N3C6=CC=CC=C46)Cl)C	C₂₀H₁₉ClN₄O₂	382.8
-	5,8,2'-Trihydroxyflavone - C1=CC=C(C(=C1)C2=CC(=O)C3=C(C=CC(=C3O2)O)O)O	C₁₅H₁₀O₅	270.24
-	(3S,5S,8S,9R,10R,13S,14S,17R)-3-hydroxy-10,13-dimethyl-17-[(2S)-1-[(3S)-3-methyl-3,4-dihydro-2H-pyrrol-5-yl]-1-oxopropan-2-yl]-1,2,3,4,5,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-6-one - C[C@H]1CC(=NC1)C(=O)[C@@H](C)[C@H]2CC[C@@H]3[C@@]2(CC[C@@H]4[C@H]3CC(=O)[C@@H]5[C@@]4(CC[C@@H](C5)O)C)C	C₂₇H₄₁NO₃	427.6
-	(3S)-N-[(2S,3S)-3-methyl-1-oxo-1-[[(1R)-1-phenylethyl]amino]pentan-2-yl]-1,2,3,4-tetrahydroisoquinoline-3-carboxamide - CC[C@H](C)[C@@H](C(=O)N[C@H](C)C1=CC=CC=C1)NC(=O)[C@@H]2CC3=CC=CC=C3CN2	C₂₄H₃₁N₃O₂	393.5
-	Chisonimbolinin G - C/C=C(\C)/C(=O)O[C@@H]1[C@H]2[C@H]3[C@](CO2)([C@@H](C[C@@H]([C@@]3([C@@H]4[C@@]1(C5=C([C@@H](C[C@@H]5OCC4)C6=CCOC6=O)C)C)C)OC(=O)C)OC(=O)C)C	C₃₅H₄₆O₁₀	626.7
-	(2S,5E)-2-(5-hydroxy-1-benzofuran-2-yl)-6,10-dimethylundeca-5,9-dienoic acid - CC(=CCC/C(=C/CC[C@@H](C1=CC2=C(O1)C=CC(=C2)O)C(=O)O)/C)C	C₂₁H₂₆O₄	342.4
-	methyl (6S)-3-benzyl-5-thiophen-2-ylsulfonyl-6,7-dihydro-4H-imidazo[4,5-c]pyridine-6-carboxylate - COC(=O)[C@@H]1CC2=C(CN1S(=O)(=O)C3=CC=CS3)N(C=N2)CC4=CC=CC=C4	C₁₉H₁₉N₃O₄S₂	417.5
-	(1S,2R,4aS,6S,8aR)-1-[(4R)-4,5-dihydroxy-3-methylidenepentyl]-2,5,5,8a-tetramethyl-3,4,4a,6,7,8-hexahydro-1H-naphthalene-2,6-diol - C[C@@]12CC[C@@H](C([C@H]1CC[C@@]([C@H]2CCC(=C)[C@H](CO)O)(C)O)(C)C)O	C₂₀H₃₆O₄	340.5
-	(3S,4aR,5S,8aS)-4a,5-dimethyl-3-prop-1-en-2-yl-2,3,4,5,6,8a-hexahydronaphthalen-1-one - C[C@H]1CC=C[C@H]2[C@@]1(C[C@@H](CC2=O)C(=C)C)C	C₁₅H₂₂O	218.33