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CAS No.	英文名/中文名/SMILES	分子式	分子量
-	[(3S,8R,9R,10R,13R,14S,17R)-10,13-dimethyl-17-[(2R)-6-methylheptan-2-yl]-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl] (E)-3-chloro-2-methylbut-2-enoate - C[C@H](CCCC(C)C)[C@H]1CC[C@@H]2[C@@]1(CC[C@@H]3[C@@H]2CC=C4[C@@]3(CC[C@@H](C4)OC(=O)/C(=C(\C)/Cl)/C)C)C	C₃₂H₅₁ClO₂	503.2
-	2-[(1S,4aS,8aR)-5,5,8a-trimethyl-2-methylidene-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]acetaldehyde - C[C@@]12CCCC([C@@H]1CCC(=C)[C@@H]2CC=O)(C)C	C₁₆H₂₆O	234.38
-	N-benzyl-3-(7-hydroxy-4-methyl-2-oxo-2H-chromen-3-yl)-N-methylpropanamide - CC1=C(C(=O)OC2=C1C=CC(=C2)O)CCC(=O)N(C)CC3=CC=CC=C3	C₂₁H₂₁NO₄	351.4
-	[(1S,4R,5R,6S,9R,10R,13R,14R)-6-[(2S,4R,5S,6R)-4-methoxy-6-methyl-5-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-[[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]oxan-2-yl]oxyoxan-2-yl]oxy-9,13-dimethyl-17-oxo-14-(5-oxo-2H-furan-3-yl)-5-tetracyclo[11.3.1.01,10.04,9]heptadecanyl] acetate - C[C@@H]1[C@@H]([C@@H](C[C@@H](O1)O[C@H]2CC[C@]3([C@H]([C@H]2OC(=O)C)CC[C@@]45[C@@H]3CC[C@@](C4=O)([C@H](CC5)C6=CC(=O)OC6)C)C)OC)O[C@H]7[C@@H]([C@H]([C@@H]([C@H](O7)CO[C@H]8[C@@H]([C@H]([C@@H]([C@H](O8)CO)O)O)O)O)O)O	C₄₄H₆₆O₁₉	899.0
-	(3S)-3-[3-oxo-3-[4-(2-pyridin-4-ylethyl)piperazin-1-yl]propyl]-3,4-dihydro-1H-1,4-benzodiazepine-2,5-dione - C1CN(CCN1CCC2=CC=NC=C2)C(=O)CC[C@H]3C(=O)NC4=CC=CC=C4C(=O)N3	C₂₃H₂₇N₅O₃	421.5
-	1-Pentadecanoyl-2-palmitoyl-3-eicsoatetraenoyl-glycerol - CCCCCCCCCCCCCCCC(=O)O[C@@H](COC(=O)CCCCCCCCCCCCCC)COC(=O)CCCCCC/C=C\C/C=C\C/C=C\C/C=C\CC	C₅₄H₉₆O₆	841.3
-	[(2R)-2-(15-methylhexadecanoyloxy)-3-(14-methylpentadecanoyloxy)propyl] heptadecanoate - CCCCCCCCCCCCCCCCC(=O)OC[C@H](COC(=O)CCCCCCCCCCCCC(C)C)OC(=O)CCCCCCCCCCCCCC(C)C	C₅₃H₁₀₂O₆	835.4
-	(2R)-2-hydroxy-14-methylpentadecanoic acid - CC(C)CCCCCCCCCCC[C@H](C(=O)O)O	C₁₆H₃₂O₃	272.42
-	(1S,2S,5R)-2-methyl-5-[(2R)-1-oxopropan-2-yl]cyclopentane-1-carbaldehyde - C[C@H]1CC[C@@H]([C@H]1C=O)[C@@H](C)C=O	C₁₀H₁₆O₂	168.23
-	1-[[(2R,4S,5R)-5-ethyl-1-azabicyclo[2.2.2]octan-2-yl]methyl]-3-propylurea - CCCNC(=O)NC[C@H]1C[C@@H]2CCN1C[C@@H]2CC	C₁₄H₂₇N₃O	253.38