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CAS No.	英文名/中文名/SMILES	分子式	分子量
257863-04-0	1-(4-Aminophenyl)-3,5-Dimethyl-1h-Pyrazole-4-Carboxylic Acid Ethyl Ester - CCOC(=O)C1=C(N(N=C1C)C2=CC=C(C=C2)N)C	C₁₄H₁₇N₃O₂	259.30
-	(4S,5S,10S,13R,14R,17R)-4,10,13-trimethyl-17-[(2R)-5-oxohexan-2-yl]-1,2,4,5,6,12,14,15,16,17-decahydrocyclopenta[a]phenanthrene-3,7,11-trione - C[C@H]1[C@@H]2CC(=O)C3=C([C@]2(CCC1=O)C)C(=O)C[C@]4([C@H]3CC[C@@H]4[C@H](C)CCC(=O)C)C	C₂₆H₃₆O₄	412.6
-	1-Methoxy-2-(2-methoxy-5-prop-2-enylphenoxy)-4-prop-2-enylbenzene - COC1=C(C=C(C=C1)CC=C)OC2=C(C=CC(=C2)CC=C)OC	C₂₀H₂₂O₃	310.4
-	6-[(8a-Carboxy-4,4,6a,6b,11,11,14b-heptamethyl-1,2,3,4a,5,6,7,8,9,10,12,12a,14,14a-tetradecahydropicen-3-yl)oxy]-5-[4,5-dihydroxy-6-(hydroxymethyl)-3-(3,4,5-trihydroxy-6-methyloxan-2-yl)oxyoxan-2-yl]oxy-3,4-dihydroxyoxane-2-carboxylic acid - CC1C(C(C(C(O1)OC2C(C(C(OC2OC3C(C(C(OC3OC4CCC5(C(C4(C)C)CCC6(C5CC=C7C6(CCC8(C7CC(CC8)(C)C)C(=O)O)C)C)C)C(=O)O)O)O)CO)O)O)O)O)O	C₄₈H₇₆O₁₈	941.1
-	(2S,3S,4R,5S,6S)-6-[5,7-dihydroxy-2-(4-hydroxy-3-methoxyphenyl)-4-oxochromen-3-yl]oxy-3,4,5-trihydroxyoxane-2-carboxylic acid - COC1=C(C=CC(=C1)C2=C(C(=O)C3=C(C=C(C=C3O2)O)O)O[C@H]4[C@H]([C@@H]([C@@H]([C@H](O4)C(=O)O)O)O)O)O	C₂₂H₂₀O₁₃	492.4
-	Methyl 6-oxohexadeca-7,9,12,15-tetraenoate - COC(=O)CCCCC(=O)C=CC=CCC=CCC=C	C₁₇H₂₄O₃	276.4
-	N-[(1S,2S,4aS,7R,8S,8aS)-8-hydroxy-1,4a-dimethyl-7-[(2S)-1-morpholin-4-yl-1-oxopropan-2-yl]-2,3,4,5,6,7,8,8a-octahydro-1H-naphthalen-2-yl]-2-phenoxyacetamide - C[C@@H]1[C@H](CC[C@]2([C@H]1[C@H]([C@H](CC2)[C@H](C)C(=O)N3CCOCC3)O)C)NC(=O)COC4=CC=CC=C4	C₂₇H₄₀N₂O₅	472.6
-	methyl 3-[(2S)-2-ethoxy-3,4-dimethyl-5-oxofuran-2-yl]propanoate - CCO[C@@]1(C(=C(C(=O)O1)C)C)CCC(=O)OC	C₁₂H₁₈O₅	242.27
-	7-(diethylamino)-3-{5-[(4-phenoxyphenyl)amino]-1,3,4-thiadiazol-2-yl}-2H-chromen-2-one - CCN(CC)C1=CC2=C(C=C1)C=C(C(=O)O2)C3=NN=C(S3)NC4=CC=C(C=C4)OC5=CC=CC=C5	C₂₇H₂₄N₄O₃S	484.6
-	5-[(3S,8R,9S,10R,12R,13S,14S,17S)-12,14-dihydroxy-10,13-dimethyl-3-[(2R,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxy-1,2,3,6,7,8,9,11,12,15,16,17-dodecahydrocyclopenta[a]phenanthren-17-yl]pyran-2-one - C[C@H]1[C@@H]([C@H]([C@H]([C@@H](O1)O[C@H]2CC[C@@]3([C@H]4C[C@H]([C@@]5([C@@H](CC[C@@]5([C@@H]4CCC3=C2)O)C6=COC(=O)C=C6)C)O)C)O)O)O	C₃₀H₄₂O₉	546.6