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CAS No.	英文名/中文名/SMILES	分子式	分子量
-	(3S)-3-hydroxy-5-[[(1S,2S,3'R,4S,6R,7S,8R,9S,12S,13R,16S)-16-[(2R,3R,4S,5R,6R)-5-hydroxy-6-(hydroxymethyl)-4-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]oxy-7,9,13-trimethylspiro[5-oxapentacyclo[10.8.0.02,9.04,8.013,18]icos-18-ene-6,6'-oxane]-3'-yl]methoxy]-3-methyl-5-oxopentanoic acid - C[C@H]1[C@H]2[C@H](C[C@@H]3[C@@]2(CC[C@H]4[C@H]3CC=C5[C@@]4(CC[C@@H](C5)O[C@H]6[C@@H]([C@H]([C@@H]([C@H](O6)CO)O)O[C@H]7[C@@H]([C@H]([C@@H]([C@H](O7)CO)O)O)O)O[C@H]8[C@@H]([C@@H]([C@H]([C@@H](O8)C)O)O)O)C)C)O[C@]19CC[C@H](CO9)COC(=O)C[C@](C)(CC(=O)O)O	C₅₁H₈₀O₂₂	1045.2
-	(1S,5R,7R)-4-hydroxy-5-(3-hydroxy-3-methylbutyl)-8,8-dimethyl-3,7-bis(3-methylbut-2-enyl)-1-(2-methylpropanoyl)bicyclo[3.3.1]non-3-ene-2,9-dione - CC(C)C(=O)[C@@]12C(=O)C(=C([C@](C1=O)(C[C@H](C2(C)C)CC=C(C)C)CCC(C)(C)O)O)CC=C(C)C	C₃₀H₄₆O₅	486.7
-	3'-Demethoxy-6'-desmethyl-5'-methoxycandidusin B - COC1=C(C2=C(C=C1C3=CC(=C(C=C3)O)O)OC4=CC(=C(C=C42)O)O)O	C₁₉H₁₄O₇	354.3
-	(2S,9S,13S,17R)-1,7-diazatetracyclo[7.7.1.02,7.013,17]heptadecane - C1CCN2C[C@@H]3CCC[C@@H]4[C@H]3N([C@H]2C1)CCC4	C₁₅H₂₆N₂	234.38
3625-01-2	(1R,4aS,7S,10aR)-7-ethenyl-1,4a,7-trimethyl-3,4,5,6,8,9,10,10a-octahydro-2H-phenanthrene-1-carboxylic acid - C[C@@]1(CCC2=C(C1)CC[C@@H]3[C@@]2(CCC[C@@]3(C)C(=O)O)C)C=C	C₂₀H₃₀O₂	302.5
-	[(3aR,4S,6E,10E,11aR)-6,10-bis(hydroxymethyl)-3-methylidene-2-oxo-3a,4,5,8,9,11a-hexahydrocyclodeca[b]furan-4-yl] 2-methylpropanoate - CC(C)C(=O)O[C@H]1C/C(=C\CC/C(=C\[C@@H]2[C@@H]1C(=C)C(=O)O2)/CO)/CO	C₁₉H₂₆O₆	350.4
-	(1R,4Z,6R,7S,17R)-4-Ethylidene-7-hydroxy-6,7-dimethyl-2,9-dioxa-14-azatricyclo[9.5.1.014,17]heptadec-11-ene-3,8-dione - C/C=C\1/C[C@H]([C@](C(=O)OCC2=CCN3[C@H]2[C@@H](CC3)OC1=O)(C)O)C	C₁₈H₂₅NO₅	335.4
-	[(1R,2R,5R)-5-methyl-2-propan-2-ylcyclohexyl] (E)-2-benzyl-3-phenylprop-2-enoate - C[C@@H]1CC[C@@H]([C@@H](C1)OC(=O)/C(=C/C2=CC=CC=C2)/CC3=CC=CC=C3)C(C)C	C₂₆H₃₂O₂	376.5
-	1-hydroxy-9,10-dioxo-3-[(2S,3R,4S,5R,6R)-3,4,5-trihydroxy-6-[[(2R,3S,4S,5S)-3,4,5-trihydroxyoxan-2-yl]oxymethyl]oxan-2-yl]oxyanthracene-2-carboxylic acid - C1[C@@H]([C@@H]([C@@H]([C@H](O1)OC[C@@H]2[C@@H]([C@@H]([C@H]([C@@H](O2)OC3=C(C(=C4C(=C3)C(=O)C5=CC=CC=C5C4=O)O)C(=O)O)O)O)O)O)O)O	C₂₆H₂₆O₁₅	578.5
-	(2R,3R,4S,5S,6S)-6-[[(3S,4S,4aR,6aR,6bS,8R,8aR,9R,10R,12aS,14aR,14bR)-9-acetyloxy-8-hydroxy-4,8a-bis(hydroxymethyl)-4,6a,6b,11,11,14b-hexamethyl-10-[(E)-2-methylbut-2-enoyl]oxy-1,2,3,4a,5,6,7,8,9,10,12,12a,14,14a-tetradecahydropicen-3-yl]oxy]-3-[(2R,3S,4R,5R,6S)-4,5-dihydroxy-6-(hydroxymethyl)-3-[(2R,3S,4R,5R,6S)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-4,5-dihydroxyoxane-2-carboxylic acid - C/C=C(\C)/C(=O)O[C@H]1[C@@H]([C@@]2([C@@H](C[C@@]3(C(=CC[C@H]4[C@]3(CC[C@@H]5[C@@]4(CC[C@@H]([C@]5(C)CO)O[C@@H]6[C@H]([C@@H]([C@H]([C@@H](O6)C(=O)O)O[C@@H]7[C@H]([C@@H]([C@H]([C@@H](O7)CO)O)O)O[C@@H]8[C@H]([C@@H]([C@H]([C@@H](O8)CO)O)O)O)O)O)C)C)[C@@H]2CC1(C)C)C)O)CO)OC(=O)C	C₅₅H₈₆O₂₄	1131.3