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CAS No.	英文名/中文名/SMILES	分子式	分子量
-	2-Ethyl-8-[(4-morpholin-4-ylphenyl)methyl]-1-oxa-2,8-diazaspiro[4.5]decan-3-one - CCN1C(=O)CC2(O1)CCN(CC2)CC3=CC=C(C=C3)N4CCOCC4	C₂₀H₂₉N₃O₃	359.5
-	1-Homo-g-linolenoyl-2-myristoyl-3-osbondoyl-glycerol - CCCCCCCCCCCCCC(=O)O[C@@H](COC(=O)CCCCCC/C=C\C/C=C\C/C=C\CCCCC)COC(=O)CC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCCCC	C₅₉H₉₈O₆	903.4
-	N~2~-[(7S)-7-(acetylamino)-1,2,3-trimethoxy-9-oxo-5,6,7,9-tetrahydrobenzo[a]heptalen-10-yl]-N-(furan-2-ylmethyl)-L-alaninamide - C[C@@H](C(=O)NCC1=CC=CO1)NC2=CC=C3C(=CC2=O)[C@H](CCC4=CC(=C(C(=C43)OC)OC)OC)NC(=O)C	C₂₉H₃₃N₃O₇	535.6
-	(1S,7R)-1,10,10-trimethyl-4-phenyl-3,4-diazatricyclo[5.2.1.02,6]deca-2,5-diene - C[C@]12CC[C@H](C1(C)C)C3=CN(N=C23)C4=CC=CC=C4	C₁₇H₂₀N₂	252.35
-	(8S)-8-chlorobicyclo[4.2.0]octa-1,3,5-trien-7-one - C1=CC=C2C(=C1)[C@@H](C2=O)Cl	C₈H₅ClO	152.58
-	[(1S,2S)-2-hydroxy-1-[(2S)-6-oxo-2,3-dihydropyran-2-yl]-2-phenylethyl] acetate - CC(=O)O[C@H]([C@@H]1CC=CC(=O)O1)[C@H](C2=CC=CC=C2)O	C₁₅H₁₆O₅	276.28
-	(2S)-2-[[(7S)-7-acetamido-1,2,3-trimethoxy-9-oxo-6,7-dihydro-5H-benzo[a]heptalen-10-yl]amino]-N-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)-3-methylbutanamide - CC(C)[C@@H](C(=O)NC1=NC2=C(S1)CCC2)NC3=CC=C4C(=CC3=O)[C@H](CCC5=CC(=C(C(=C54)OC)OC)OC)NC(=O)C	C₃₂H₃₈N₄O₆S	606.7
-	[(2R,3S,4S,5S,6S)-3,4,5,6-tetrahydroxyoxan-2-yl]methyl 2-[(2-methylpropan-2-yl)oxycarbonylamino]acetate - CC(C)(C)OC(=O)NCC(=O)OC[C@@H]1[C@H]([C@@H]([C@@H]([C@H](O1)O)O)O)O	C₁₃H₂₃NO₉	337.32
-	8-Benzyl-3-(4-methylphenyl)-1,4,8-triazaspiro[4.5]dec-3-en-2-one - CC1=CC=C(C=C1)C2=NC3(CCN(CC3)CC4=CC=CC=C4)NC2=O	C₂₁H₂₃N₃O	333.4
-	2-[[(4S)-4-[[(4S)-4-[[(4S)-4-[[4-[2-(2-amino-4-oxo-3,7-dihydropyrrolo[2,3-d]pyrimidin-5-yl)ethyl]benzoyl]amino]-4-carboxybutanoyl]amino]-4-carboxybutanoyl]amino]-4-carboxybutanoyl]amino]pentanedioic acid - C1=CC(=CC=C1CCC2=CNC3=C2C(=O)NC(=N3)N)C(=O)N[C@@H](CCC(=O)N[C@@H](CCC(=O)N[C@@H](CCC(=O)NC(CCC(=O)O)C(=O)O)C(=O)O)C(=O)O)C(=O)O	C₃₅H₄₂N₈O₁₅	814.8