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CAS No.	英文名/中文名/SMILES	分子式	分子量
-	(3S,10S,13S,14S)-4,4,10,13,14-pentamethyl-17-[(2R)-6-methyl-5-methylideneheptan-2-yl]-2,3,5,6,7,11,12,15,16,17-decahydro-1H-cyclopenta[a]phenanthren-3-ol - C[C@H](CCC(=C)C(C)C)C1CC[C@]2([C@]1(CCC3=C2CCC4[C@@]3(CC[C@@H](C4(C)C)O)C)C)C	C₃₁H₅₂O	440.7
-	(E,3S)-9-thiophen-2-ylnon-6-en-8-yn-3-ol - CC[C@@H](CC/C=C/C#CC1=CC=CS1)O	C₁₃H₁₆OS	220.33
-	(3aR,4aR,8aR,9aR)-3-[[(1R)-6-hydroxy-7-methoxy-1-methyl-3,4-dihydro-1H-isoquinolin-2-yl]methyl]-8a-methylspiro[3a,4,4a,6,7,8,9,9a-octahydro-3H-benzo[f][1]benzofuran-5,2'-oxirane]-2-one - C[C@@H]1C2=CC(=C(C=C2CCN1CC3[C@H]4C[C@@H]5[C@](CCCC56CO6)(C[C@H]4OC3=O)C)O)OC	C₂₆H₃₅NO₅	441.6
33644-09-6	Isoavenaciolide - CCCCCCCC[C@H]1[C@@H]2[C@H](C(=O)O1)OC(=O)C2=C	C₁₅H₂₂O₄	266.33
-	[(2R)-3-(15-methylhexadecanoyloxy)-2-octadecanoyloxypropyl] 17-methyloctadecanoate - CCCCCCCCCCCCCCCCCC(=O)O[C@H](COC(=O)CCCCCCCCCCCCCCCC(C)C)COC(=O)CCCCCCCCCCCCCC(C)C	C₅₇H₁₁₀O₆	891.5
-	3-[[(2R,3S,4S,5R,6R)-6-(2-aminoethoxy)-3,4-dihydroxy-5-[[(1S,12S)-17-[(4-hydroxyphenyl)methyl]-5,7,11,19-tetraoxapentacyclo[10.8.0.02,10.04,8.013,18]icosa-2,4(8),9,13,15,17-hexaen-15-yl]peroxy]oxan-2-yl]methoxy]-3-oxopropanoic acid - C1[C@H]2[C@@H](C3=CC(=CC(=C3O1)CC4=CC=C(C=C4)O)OO[C@@H]5[C@H]([C@@H]([C@H](O[C@H]5OCCN)COC(=O)CC(=O)O)O)O)OC6=CC7=C(C=C26)OCO7	C₃₄H₃₅NO₁₅	697.6
-	N-(4-chlorophenyl)-2-(1H-indol-3-yl)acetamide - C1=CC=C2C(=C1)C(=CN2)CC(=O)NC3=CC=C(C=C3)Cl	C₁₆H₁₃ClN₂O	284.74
-	methyl (3S,4aR,4bR,10R,10aR,10bR,12aS)-6,10-dihydroxy-3,4b,7,7,10a,12a-hexamethyl-12-methylidene-1,4,5,8-tetraoxo-9,10,10b,11-tetrahydronaphtho[2,1-f]isochromene-4a-carboxylate - C[C@H]1C(=O)[C@]2([C@]3([C@H](CC(=C)[C@@]2(C(=O)O1)C)[C@]4([C@@H](CC(=O)C(C4=C(C3=O)O)(C)C)O)C)C)C(=O)OC	C₂₆H₃₂O₉	488.5
-	methyl (3S)-3-[3-hydroxy-6-[(3-methoxyphenyl)sulfanylmethyl]-4-oxopyran-2-yl]-5-methylhexanoate - CC(C)C[C@@H](CC(=O)OC)C1=C(C(=O)C=C(O1)CSC2=CC=CC(=C2)OC)O	C₂₁H₂₆O₆S	406.5
-	(4aS,7aR)-5-(2-phenoxyacetyl)-3-(4-phenoxyphenyl)-4a,6,7,7a-tetrahydro-1H-pyrrolo[3,2-d]pyrimidine-2,4-dione - C1CN([C@H]2[C@@H]1NC(=O)N(C2=O)C3=CC=C(C=C3)OC4=CC=CC=C4)C(=O)COC5=CC=CC=C5	C₂₆H₂₃N₃O₅	457.5