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CAS No.	英文名/中文名/SMILES	分子式	分子量
-	(8aR)-2-benzyl-7-(1-methylpiperidine-4-carbonyl)spiro[5,6,8,8a-tetrahydroimidazo[1,5-a]pyrazine-3,4'-oxane]-1-one - CN1CCC(CC1)C(=O)N2CCN3[C@H](C2)C(=O)N(C34CCOCC4)CC5=CC=CC=C5	C₂₄H₃₄N₄O₃	426.6
-	[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl] (1R,2R,3S,4S,5R,9S,10S,13R,14S)-2,3,14-trihydroxy-14-(hydroxymethyl)-5,9-dimethyltetracyclo[11.2.1.01,10.04,9]hexadecane-5-carboxylate - C[C@@]12CCC[C@@]([C@H]1[C@@H]([C@@H]([C@]34[C@H]2CC[C@H](C3)[C@@](C4)(CO)O)O)O)(C)C(=O)O[C@H]5[C@@H]([C@H]([C@@H]([C@H](O5)CO)O)O)O	C₂₆H₄₂O₁₁	530.6
86778-06-5	Tanacetol A - C/C/1=C\[C@@H](CC(=C)C(=O)C[C@@H](CC1)C(C)(C)O)OC(=O)C	C₁₇H₂₆O₄	294.4
-	(2R,3R,4R,5S,6R)-6-[[(3R,4S,4aR,6aR,6bS,8aR,9R,12aS,14aR,14bR)-9-[(2S,3S,4R,5R)-4,5-dihydroxy-3-[(2R,3R,4S,5R,6S)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-4-(hydroxymethyl)-4,6a,6b,8a,11,11,14b-heptamethyl-1,2,3,4a,5,6,7,8,9,10,12,12a,14,14a-tetradecahydropicen-3-yl]oxy]-5-[(2S,3R,4R,5R,6R)-4,5-dihydroxy-6-(hydroxymethyl)-3-[(2R,3S,4R,5R,6R)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]oxy-3,4-dihydroxyoxane-2-carboxylic acid - C[C@@H]1[C@@H]([C@H]([C@@H]([C@H](O1)O[C@@H]2[C@@H]([C@H]([C@H](O[C@H]2O[C@H]3[C@@H]([C@H]([C@@H](O[C@H]3O[C@@H]4CC[C@]5([C@H]([C@@]4(C)CO)CC[C@@]6([C@@H]5CC=C7[C@]6(CC[C@@]8([C@H]7CC(C[C@H]8O[C@H]9[C@H]([C@@H]([C@@H](CO9)O)O)O[C@@H]1[C@@H]([C@H]([C@H]([C@@H](O1)CO)O)O)O)(C)C)C)C)C)C)C(=O)O)O)O)CO)O)O)O)O)O	C₅₉H₉₆O₂₇	1237.4
-	[(1R,2S,6R,10S,11R,13R,15R,17R)-13-benzyl-6-hydroxy-4,17-dimethyl-5-oxo-15-prop-1-en-2-yl-12,14,18-trioxapentacyclo[11.4.1.01,10.02,6.011,15]octadeca-3,8-dien-8-yl]methyl 2-(4-hydroxyphenyl)acetate - C[C@@H]1C[C@]2([C@H]3[C@H]4[C@]1([C@H]5C=C(C(=O)[C@]5(CC(=C4)COC(=O)CC6=CC=C(C=C6)O)O)C)O[C@@](O3)(O2)CC7=CC=CC=C7)C(=C)C	C₃₆H₃₈O₈	598.7
-	5-O-Mycarosyltylactone - CC[C@H]1C[C@H](C(=O)/C=C/C(=C/[C@H]([C@H](OC(=O)C[C@H]([C@@H]([C@H]1O[C@H]2C[C@@]([C@H]([C@@H](O2)C)O)(C)O)C)O)CC)C)/C)C	C₃₀H₅₀O₈	538.7
-	(1S)-1-(2,5-dimethoxyphenyl)-2-methyl-1H-chromeno[2,3-c]pyrrole-3,9-dione - CN1[C@H](C2=C(C1=O)OC3=CC=CC=C3C2=O)C4=C(C=CC(=C4)OC)OC	C₂₀H₁₇NO₅	351.4
-	1-(4-Bromophenyl)-1-hydroxy-3-[4-[(4-methylphenyl)carbamoylamino]butyl]urea - CC1=CC=C(C=C1)NC(=O)NCCCCNC(=O)N(C2=CC=C(C=C2)Br)O	C₁₉H₂₃BRN₄O₃	435.3
-	[(1R,2R,3S,4S,5S)-5-[2-(3,4-dihydroxyphenyl)ethoxy]-2,4-dihydroxy-3-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxycyclohexyl]methyl 3-(3,4-dihydroxyphenyl)prop-2-enoate - C1[C@@H]([C@H]([C@@H]([C@H]([C@H]1OCCC2=CC(=C(C=C2)O)O)O)O[C@@H]3[C@@H]([C@H]([C@@H]([C@H](O3)CO)O)O)O)O)COC(=O)C=CC4=CC(=C(C=C4)O)O	C₃₀H₃₈O₁₅	638.6
-	(3R,4S)-4-(1,4-dioxa-8-azaspiro[4.5]decane-8-carbonyl)-2-methyl-3-thiophen-2-yl-3,4-dihydroisoquinolin-1-one - CN1[C@H]([C@H](C2=CC=CC=C2C1=O)C(=O)N3CCC4(CC3)OCCO4)C5=CC=CS5	C₂₂H₂₄N₂O₄S	412.5