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CAS No.	英文名/中文名/SMILES	分子式	分子量
-	(1R,2S,5S,8S,9S,10R,11R,13R)-5-hydroxy-11-methyl-6-methylidene-16-oxo-13-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-15-oxapentacyclo[9.3.2.15,8.01,10.02,8]heptadecane-9-carboxylic acid - C[C@@]12C[C@H](C[C@@]3([C@@H]1[C@@H]([C@]45[C@@H]3CC[C@](C4)(C(=C)C5)O)C(=O)O)OC2=O)O[C@@H]6[C@@H]([C@H]([C@@H]([C@H](O6)CO)O)O)O	C₂₅H₃₄O₁₁	510.5
5454-24-0	Undecyl formate - CCCCCCCCCCCOC=O	C₁₂H₂₄O₂	200.32
-	sodium;[(2R,3S,4S,6S)-4-hydroxy-2-(2-hydroxypropyl)-6-[1,4,8-trihydroxy-13-[3-[(11E,15E,19E)-21-[(2S,3R,5R)-3-hydroxy-5-(2-methylidenepent-4-enyl)oxolan-2-yl]-3-methyl-17-methylidenehenicosa-11,15,19-trienyl]oxiran-2-yl]-6-oxo-10-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxytridecyl]oxan-3-yl] sulfate - CC(CCCCCCC/C=C/CC/C=C/C(=C)C/C=C/C[C@H]1[C@@H](C[C@H](O1)CC(=C)CC=C)O)CCC2C(O2)CCCC(CC(CC(=O)CC(CCC([C@@H]3C[C@@H]([C@@H]([C@H](O3)CC(C)O)OS(=O)(=O)[O-])O)O)O)O)O[C@H]4[C@@H]([C@H]([C@@H]([C@H](O4)CO)O)O)O.[Na+]	C₆₂H₁₀₃NAO₂₀S	1223.5
-	10-formamido-kalihinol F - C[C@@]1(CC[C@@H]([C@@H]2[C@@H]1CC[C@@]([C@@H]2N=C)(C)O)[C@]3(CC[C@H](O3)C(C)(C)N=C)C)NC=O	C₂₃H₃₉N₃O₃	405.6
-	Dehydroocoteine - CN1CCC2=C(C3=C(C4=C5C=C(C(=CC5=CC1=C24)OC)OC)OCO3)OC	C₂₁H₂₁NO₅	367.4
-	(5S,8S)-6-ethyl-14-methyl-6,10-diazatetracyclo[8.6.1.05,17.011,16]heptadeca-1(17),11(16),12,14-tetraen-8-ol - CCN1C[C@@H](CN2C3=C(C=C(C=C3)C)C4=C2[C@@H]1CCC4)O	C₁₈H₂₄N₂O	284.4
5653-42-9	6,7-dimethoxy-4H-isochromene-1,3-dione - COC1=C(C=C2C(=C1)CC(=O)OC2=O)OC	C₁₁H₁₀O₅	222.19
-	4-[[(3R,5R,8R,9S,10S,12S,13S,14S,17R)-12,14-dihydroxy-10,13-dimethyl-17-(5-oxo-2H-furan-3-yl)-1,2,3,4,5,6,7,8,9,11,12,15,16,17-tetradecahydrocyclopenta[a]phenanthren-3-yl]oxy]-4-oxobutanoic acid - C[C@]12CC[C@H](C[C@H]1CC[C@@H]3[C@@H]2C[C@@H]([C@]4([C@@]3(CC[C@@H]4C5=CC(=O)OC5)O)C)O)OC(=O)CCC(=O)O	C₂₇H₃₈O₈	490.6
-	(1R,3aS,5aS,5bR,7R,7aR,11aR,11bR,13aR,13bR)-7-hydroxy-5b,8,8,11a-tetramethyl-9-oxo-1-prop-1-en-2-yl-2,3,4,5,6,7,7a,10,11,11b,12,13,13a,13b-tetradecahydro-1H-cyclopenta[a]chrysene-3a,5a-dicarboxylic acid - CC(=C)[C@@H]1CC[C@]2([C@H]1[C@H]3CC[C@@H]4[C@]5(CCC(=O)C([C@@H]5[C@@H](C[C@]4([C@@]3(CC2)C(=O)O)C)O)(C)C)C)C(=O)O	C₃₀H₄₄O₆	500.7
-	6-Acetyl-2,2-dimethyl-8-(3-methyl-2-butenyl)-2H-1-benzopyran - CC(=CCC1=CC(=CC2=C1OC(C=C2)(C)C)C(=O)C)C	C₁₈H₂₂O₂	270.4