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CAS No.	英文名/中文名/SMILES	分子式	分子量
-	1-[3-[(2R,4aS,5S,10bS)-5-ethyl-2,5-dimethyl-3,4,4a,10b-tetrahydropyrano[3,2-c]chromen-2-yl]prop-2-ynyl]-1-methylpiperidin-1-ium - CC[C@]1([C@H]2CC[C@](O[C@@H]2C3=CC=CC=C3O1)(C)C#CC[N+]4(CCCCC4)C)C	C₂₅H₃₆NO₂+	382.6
-	(1S,2R,5S,6S,7R)-2-N-[(1R,2R,3S)-2,3-dimethylcyclohexyl]-3-[2-(dipropylamino)ethyl]-4-oxo-6-N-(4-propan-2-ylphenyl)-10-oxa-3-azatricyclo[5.2.1.01,5]dec-8-ene-2,6-dicarboxamide - CCCN(CCC)CCN1[C@H]([C@@]23C=C[C@@H](O2)[C@H]([C@@H]3C1=O)C(=O)NC4=CC=C(C=C4)C(C)C)C(=O)N[C@@H]5CCC[C@@H]([C@H]5C)C	C₃₅H₅₂N₄O₄	592.8
-	4-chloro-2-[(2S)-2-(3,4-dimethoxyphenyl)-9-methyl-1,5,9-triazaspiro[5.5]undec-4-en-4-yl]phenol - CN1CCC2(CC1)N[C@@H](CC(=N2)C3=C(C=CC(=C3)Cl)O)C4=CC(=C(C=C4)OC)OC	C₂₃H₂₈ClN₃O₃	429.9
-	1-Eicosadienoyl-2-meadoyl-3-osbondoyl-glycerol - CCCCCCCC/C=C\C/C=C\C/C=C\CCCC(=O)O[C@@H](COC(=O)CCCCCCCCC/C=C\C/C=C\CCCCC)COC(=O)CC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCCCC	C₆₅H₁₀₆O₆	983.5
-	N-[(1R,2R,5S)-5-(2,5-dimethyl-1,2,4-triazol-3-yl)-2-hydroxycyclohexyl]pyridine-3-carboxamide - CC1=NN(C(=N1)[C@H]2CC[C@H]([C@@H](C2)NC(=O)C3=CN=CC=C3)O)C	C₁₆H₂₁N₅O₂	315.37
-	N-(5-Chloro-2,4-dimethoxyphenyl)-5'H-spiro[piperidine-4,4'-pyrrolo[1,2-A]quinoxaline]-1-carboxamide - COC1=CC(=C(C=C1NC(=O)N2CCC3(CC2)C4=CC=CN4C5=CC=CC=C5N3)Cl)OC	C₂₄H₂₅ClN₄O₃	452.9
-	Cyclohexyl 11-acetyloxy-2-hydroxy-10,15-dimethyl-4,9,13-trioxatetracyclo[10.3.0.03,5.08,10]pentadeca-1(12),14-diene-5-carboxylate - CC1=COC2=C1C(C3C(O3)(CCC4C(C2OC(=O)C)(O4)C)C(=O)OC5CCCCC5)O	C₂₃H₃₀O₈	434.5
-	[(1S,4S,4aS,8aS)-4-hydroxy-3,4-bis(hydroxymethyl)-4a,8,8-trimethyl-5,6,7,8a-tetrahydro-1H-naphthalen-1-yl] hexanoate - CCCCCC(=O)O[C@H]1C=C([C@@]([C@@]2([C@@H]1C(CCC2)(C)C)C)(CO)O)CO	C₂₁H₃₆O₅	368.5
-	TG(i-20:0/i-19:0/a-15:0) - CCC(C)CCCCCCCCCCC(=O)OC[C@H](COC(=O)CCCCCCCCCCCCCCCCC(C)C)OC(=O)CCCCCCCCCCCCCCCC(C)C	C₅₇H₁₁₀O₆	891.5
-	(1R,4S,5R,8R,10S,13S,14R,15S,19S,20S)-10-[(2S,3R,4S,5S)-4,5-dihydroxy-3-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]oxy-15,19-dihydroxy-4,5,9,9,13,19,20-heptamethyl-21-oxahexacyclo[18.2.2.01,18.04,17.05,14.08,13]tetracos-17-en-22-one - C[C@H]1[C@@H]([C@H]([C@H]([C@@H](O1)O[C@@H]2[C@H]([C@H](CO[C@H]2O[C@H]3CC[C@]4([C@H](C3(C)C)CC[C@@]5([C@@H]4[C@H](CC6=C7[C@]([C@@]8(CC[C@@]7(CC[C@]65C)C(=O)O8)C)(C)O)O)C)C)O)O)O)O)O	C₄₁H₆₄O₁₃	764.9