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CAS No.	英文名/中文名/SMILES	分子式	分子量
-	2-[(4S,12R,14R)-7-cyclopentyloxy-12-hydroxy-4-(2-hydroxypropan-2-yl)-10-(3-methylbutyl)-9-oxo-3,20-dioxa-16,17-dithiatetracyclo[9.7.2.02,6.08,19]icosa-1(19),2(6),7,10-tetraen-14-yl]guanidine - CC(C)CCC1=C2[C@@H](C[C@H](CSSCC3=C(O2)C(=C(C4=C3O[C@@H](C4)C(C)(C)O)OC5CCCC5)C1=O)N=C(N)N)O	C₃₀H₄₃N₃O₆S₂	605.8
-	8-hydrazinyl-1,3-dimethyl-7-[(1R)-1-phenylethyl]purine-2,6-dione - C[C@H](C1=CC=CC=C1)N2C3=C(N=C2NN)N(C(=O)N(C3=O)C)C	C₁₅H₁₈N₆O₂	314.34
-	[(1S,2S,4R,8S,9R,11S,12S)-12-acetyloxy-1-hydroxy-2,11-dimethyl-7-methylidene-6-oxo-5,14-dioxatricyclo[9.2.1.04,8]tetradecan-9-yl] 2-methylpropanoate - C[C@H]1C[C@@H]2[C@@H]([C@@H](C[C@]3([C@H](C[C@@]1(O3)O)OC(=O)C)C)OC(=O)C(C)C)C(=C)C(=O)O2	C₂₁H₃₀O₈	410.5
-	[(2R,10R,13R,17S)-10-ethyl-17-[4-hydroxy-3-methoxy-5-(methylaminomethyl)phenyl]-2-(3-hydroxyphenyl)-15-oxo-6,21,23-triazatricyclo[20.3.1.04,8]hexacosa-1(26),4(8),6,22,24-pentaen-18-yn-13-yl] acetate - CC[C@@H]1CC[C@H](CC(=O)C[C@H](C#CCNC2=NC=CC(=C2)[C@@H](CC3=C(C1)C=NC3)C4=CC(=CC=C4)O)C5=CC(=C(C(=C5)OC)O)CNC)OC(=O)C	C₄₂H₅₀N₄O₆	706.9
-	4,6-Dimethoxy-2,9-dimethyldibenzo(b,e)(1,4)dioxine-1,7-diol - CC1=CC(=C(C2=C1OC3=C(C(=CC(=C3O2)OC)C)O)OC)O	C₁₆H₁₆O₆	304.29
-	ethyl 4-{[(6R,6aS)-3-nitro-10-oxo-6,6a,7,8,14,15-hexahydro-5H,10H-7,14-methanopyrido[1',2':5,6][1,5]diazocino[1,2-a]quinolin-6-yl]carbonyl}piperazine-1-carboxylate - CCOC(=O)N1CCN(CC1)C(=O)[C@@H]2CC3=C(C=CC(=C3)[N+](=O)[O-])N4[C@H]2C5CC(C4)C6=CC=CC(=O)N6C5	C₂₇H₃₁N₅O₆	521.6
33404-57-8	(3R)-Dunnione, (rel)- - C[C@@H]1C(C2=C(O1)C3=CC=CC=C3C(=O)C2=O)(C)C	C₁₅H₁₄O₃	242.27
-	7-[(1R,2R)-2-[(Z,3S)-3-hydroxyoct-1-enyl]-5-oxocyclopent-3-en-1-yl]heptanoic acid - CCCCC[C@@H](/C=C\[C@@H]1C=CC(=O)[C@@H]1CCCCCCC(=O)O)O	C₂₀H₃₂O₄	336.5
-	(2S,3S,4S,5R,6R)-6-[[(3S,4R,4aR,6aR,6bS,8R,8aR,12aS,14aR,14bR)-8a-[(2S,3R,4S,5R,6R)-3-(3,4-dimethoxybenzoyl)oxy-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxycarbonyl-8-hydroxy-4-(hydroxymethyl)-4,6a,6b,11,11,14b-hexamethyl-1,2,3,4a,5,6,7,8,9,10,12,12a,14,14a-tetradecahydropicen-3-yl]oxy]-3,4,5-trihydroxyoxane-2-carboxylic acid - C[C@]12CC[C@@H]([C@@]([C@@H]1CC[C@@]3([C@@H]2CC=C4[C@]3(C[C@H]([C@@]5([C@H]4CC(CC5)(C)C)C(=O)O[C@H]6[C@@H]([C@H]([C@H]([C@H](O6)CO)O)O)OC(=O)C7=CC(=C(C=C7)OC)OC)O)C)C)(C)CO)O[C@H]8[C@@H]([C@H]([C@@H]([C@H](O8)C(=O)O)O)O)O	C₅₁H₇₄O₁₉	991.1
-	(9S,11S)-3-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-9-(2-methylpropyl)-N-propyl-3,10-diazatricyclo[6.4.1.04,13]trideca-1,4,6,8(13)-tetraene-11-carboxamide - CCCNC(=O)[C@@H]1CC2=CN(C3=CC=CC(=C23)[C@@H](N1)CC(C)C)CC4=C(ON=C4C)C	C₂₅H₃₄N₄O₂	422.6