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CAS No.	英文名/中文名/SMILES	分子式	分子量
-	5-Hydroxy-10-(4-hydroxyphenyl)-2-phenyl-9,10-dihydropyrano[2,3-f]chromene-4,8-dione - C1C(C2=C(C=C(C3=C2OC(=CC3=O)C4=CC=CC=C4)O)OC1=O)C5=CC=C(C=C5)O	C₂₄H₁₆O₆	400.4
-	TG(22:0/16:0/a-17:0)[rac] - CCCCCCCCCCCCCCCCCCCCCC(=O)OC[C@@H](COC(=O)CCCCCCCCCCCCC(C)CC)OC(=O)CCCCCCCCCCCCCCC	C₅₈H₁₁₂O₆	905.5
-	(1S,2S,5R,6R,7S)-3-[(4-chlorophenyl)methyl]-2-N-cyclohexyl-6-N-(3-methylsulfanylphenyl)-4-oxo-10-oxa-3-azatricyclo[5.2.1.01,5]dec-8-ene-2,6-dicarboxamide - CSC1=CC=CC(=C1)NC(=O)[C@H]2[C@@H]3C=C[C@@]4([C@@H]2C(=O)N([C@@H]4C(=O)NC5CCCCC5)CC6=CC=C(C=C6)Cl)O3	C₃₀H₃₂ClN₃O₄S	566.1
-	methyl (1S,4aR,5S,8aR)-1,4a-dimethyl-6-methylidene-5-[2-[2-[(2-phenylethylamino)methyl]furan-3-yl]ethyl]-3,4,5,7,8,8a-hexahydro-2H-naphthalene-1-carboxylate - C[C@]12CCC[C@]([C@@H]1CCC(=C)[C@@H]2CCC3=C(OC=C3)CNCCC4=CC=CC=C4)(C)C(=O)OC	C₃₀H₄₁NO₃	463.7
-	[3-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-methyl-4-oxochromen-7-yl] (2R)-3-phenyl-2-(phenylmethoxycarbonylamino)propanoate - CC1=C(C(=O)C2=C(O1)C=C(C=C2)OC(=O)[C@@H](CC3=CC=CC=C3)NC(=O)OCC4=CC=CC=C4)C5=CC6=C(C=C5)OCCO6	C₃₅H₂₉NO₈	591.6
-	[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl] (4aR,5S,6R,8aS)-5,6,8a-trimethyl-5-[[(2R)-3-methyl-5-oxo-2H-furan-2-yl]methyl]-3,4,4a,6,7,8-hexahydronaphthalene-1-carboxylate - C[C@@H]1CC[C@]2([C@@H]([C@@]1(C)C[C@@H]3C(=CC(=O)O3)C)CCC=C2C(=O)O[C@H]4[C@@H]([C@H]([C@@H]([C@H](O4)CO)O)O)O)C	C₂₆H₃₈O₉	494.6
27664-11-5	2-Propen-1-one, 1-(4-methoxyphenyl)-3-(1-methyl-1H-indol-3-yl)- - CN1C=C(C2=CC=CC=C21)C=CC(=O)C3=CC=C(C=C3)OC	C₁₉H₁₇NO₂	291.3
-	3-[[(5R,10R,10aS)-10-amino-10-benzyl-7,9,10a-trihydroxy-3-oxo-2,5-dihydro-1H-pyrrolo[1,2-b]isoquinoline-5-carbonyl]amino]propanoic acid - C1C[C@@]2([C@](C3=C(C=C(C=C3O)O)[C@@H](N2C1=O)C(=O)NCCC(=O)O)(CC4=CC=CC=C4)N)O	C₂₃H₂₅N₃O₇	455.5
-	(5-Methyl-8-propan-2-ylnaphthalen-2-yl)methanol - CC1=C2C=CC(=CC2=C(C=C1)C(C)C)CO	C₁₅H₁₈O	214.30
-	(6S)-3-(hydroxymethyl)-6-[(2S)-6-methylhept-5-en-2-yl]cyclohex-2-en-1-one - C[C@@H](CCC=C(C)C)[C@@H]1CCC(=CC1=O)CO	C₁₅H₂₄O₂	236.35