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CAS No.	英文名/中文名/SMILES	分子式	分子量
-	(4aS,6aR,6bR,8aS,10S,12aR,14aS,14bR)-10-acetyloxy-2,2,9,9,12a,14a-hexamethyl-3,4,5,6a,6b,7,8,8a,10,11,12,13,14,14b-tetradecahydro-1H-picene-4a-carboxylic acid - CC(=O)O[C@H]1CC[C@@]2([C@@H]3CC[C@]4([C@H]5CC(CC[C@@]5(CC=C4[C@@H]3CC[C@@H]2C1(C)C)C(=O)O)(C)C)C)C	C₃₁H₄₈O₄	484.7
-	methyl N-{[(5-hydroxy-4-oxo-2-phenyl-4H-chromen-7-yl)oxy]acetyl}glycinate - COC(=O)CNC(=O)COC1=CC(=C2C(=C1)OC(=CC2=O)C3=CC=CC=C3)O	C₂₀H₁₇NO₇	383.4
-	TG(20:1(11Z)/14:0/18:3(6Z,9Z,12Z)) - CCCCCCCCCCCCCC(=O)O[C@@H](COC(=O)CCCCCCCCC/C=C\CCCCCCCC)COC(=O)CCCC/C=C\C/C=C\C/C=C\CCCCC	C₅₅H₉₈O₆	855.4
-	Apigenin 6-C-galactoside 8-C-arabinoside - C1=CC(=CC=C1C2=CC(=O)C3=C(C(=C(C(=C3O2)C4[C@H]([C@@H]([C@H](O4)CO)O)O)O)C5[C@@H]([C@H]([C@H]([C@H](O5)CO)O)O)O)O)O	C₂₆H₂₈O₁₄	564.5
-	(S)-2-(2-(2-((4-ethyl-7-methyl-2-oxo-2H-chromen-5-yl)oxy)acetamido)acetamido)-3-methylbutanoic acid - CCC1=CC(=O)OC2=C1C(=CC(=C2)C)OCC(=O)NCC(=O)N[C@@H](C(C)C)C(=O)O	C₂₁H₂₆N₂O₇	418.4
-	[(1S,4aR,5R,7aS)-7-(hydroxymethyl)-1-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-1,4a,5,7a-tetrahydrocyclopenta[c]pyran-5-yl] 4-hydroxybenzoate - C1=CO[C@H]([C@H]2[C@@H]1[C@H](C=C2CO)OC(=O)C3=CC=C(C=C3)O)O[C@H]4[C@@H]([C@H]([C@@H]([C@H](O4)CO)O)O)O	C₂₂H₂₆O₁₁	466.4
-	(8aR)-2-cyclohexyl-7-(pyridin-4-ylmethyl)-5,6,8,8a-tetrahydro-1H-imidazo[1,5-a]pyrazin-3-one - C1CCC(CC1)N2C[C@H]3CN(CCN3C2=O)CC4=CC=NC=C4	C₁₈H₂₆N₄O	314.4
-	[(2R,3S,4R,5S)-2-[[(1R,3S,5E,7Z,11S,13R,15S,16S,17S,19S,23R,25S,29E,33S,35R,37S,38S,39S,41S)-25-[(2R,3S,4R,5S)-3-[(2S)-2,3-dihydroxypropanoyl]oxy-4,5-dimethoxyoxan-2-yl]oxy-13,15,35,37-tetrahydroxy-11,33-bis[(2S,3S,4S)-3-hydroxy-6-[(2S,4R,6S)-4-methoxy-6-methyloxan-2-yl]-4-methylhexan-2-yl]-17,39-dimethoxy-6,16,28,38-tetramethyl-9,31-dioxo-10,32,45,46-tetraoxatricyclo[39.3.1.119,23]hexatetraconta-5,7,21,27,29,43-hexaen-3-yl]oxy]-4,5-dimethoxyoxan-3-yl] (2R)-2,3-dihydroxypropanoate - C[C@H]1C[C@H](C[C@@H](O1)CC[C@H](C)[C@@H]([C@H](C)[C@@H]2C[C@@H](C[C@@H]([C@@H]([C@H](C[C@@H]3CC=C[C@H](O3)C[C@H](C/C=C(/C=C\C(=O)O[C@@H](C[C@@H](C[C@@H]([C@@H]([C@H](C[C@@H]4CC=C[C@H](O4)C[C@H](CC=C(/C=C/C(=O)O2)C)O[C@@H]5[C@H]([C@@H]([C@H](CO5)OC)OC)OC(=O)[C@H](CO)O)OC)C)O)O)[C@@H](C)[C@H]([C@@H](C)CC[C@H]6C[C@@H](C[C@@H](O6)C)OC)O)\C)O[C@@H]7[C@H]([C@@H]([C@H](CO7)OC)OC)OC(=O)[C@@H](CO)O)OC)C)O)O)O)OC	C₉₆H₁₆₀O₃₄	1858.3
-	3-[(2S,3R,4S,5S,6R)-4,5-dihydroxy-6-(hydroxymethyl)-3-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]oxy-5,7-dihydroxy-2-(4-hydroxyphenyl)-8-(3-methylbut-2-enyl)chromen-4-one - 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]2OC3=C(OC4=C(C(=CC(=C4C3=O)O)O)CC=C(C)C)C5=CC=C(C=C5)O)CO)O)O)O)O)O	C₃₂H₃₈O₁₅	662.6
-	(1R,9R)-11-benzoyl-5-[[5-(hydroxymethyl)furan-2-yl]methylamino]-7,11-diazatricyclo[7.3.1.02,7]trideca-2,4-dien-6-one - C1[C@@H]2CN(C[C@@H]1C3=CC=C(C(=O)N3C2)NCC4=CC=C(O4)CO)C(=O)C5=CC=CC=C5	C₂₄H₂₅N₃O₄	419.5