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CAS No.	英文名/中文名/SMILES	分子式	分子量
-	7-Hydroxy-8-[2-oxo-7-(3,4,5-trihydroxy-6-methyloxan-2-yl)oxychromen-6-yl]chromen-2-one - CC1C(C(C(C(O1)OC2=C(C=C3C=CC(=O)OC3=C2)C4=C(C=CC5=C4OC(=O)C=C5)O)O)O)O	C₂₄H₂₀O₁₀	468.4
-	N-{[4-(4-bromophenyl)-1,4,6,7-tetrahydro-5H-imidazo[4,5-c]pyridin-5-yl]carbonyl}glycine - C1CN(C(C2=C1NC=N2)C3=CC=C(C=C3)Br)C(=O)NCC(=O)O	C₁₅H₁₅BRN₄O₃	379.21
-	(1'R,4R,5'R,14'R,15'S,16'R,18'S)-2,3'-diamino-15'-(aminomethyl)-8'-bromo-4,16'-dihydroxyspiro[1,4-dihydroimidazole-5,17'-2,4,6,12-tetrazapentacyclo[10.6.0.01,5.06,10.014,18]octadeca-3,7,9-triene]-11'-one - C1[C@H]2[C@H]([C@H](C3([C@H]2[C@@]45N1C(=O)C6=CC(=CN6[C@@H]4N=C(N5)N)Br)[C@H](N=C(N3)N)O)O)CN	C₁₇H₂₂BRN₉O₃	480.3
-	4-(4-Hydroxyphenyl)-3,4-dihydropyrano[3,2-c]chromene-2,5-dione - C1C(C2=C(C3=CC=CC=C3OC2=O)OC1=O)C4=CC=C(C=C4)O	C₁₈H₁₂O₅	308.3
-	(2S,3R,5R,10S,13R,14R,17R)-17-[(2R)-1-hydroxy-6-methyl-5-methylideneheptan-2-yl]-4,4,10,13,14-pentamethyl-2,3,5,6,7,11,12,15,16,17-decahydro-1H-cyclopenta[a]phenanthrene-2,3-diol - CC(C)C(=C)CC[C@@H](CO)[C@H]1CC[C@@]2([C@@]1(CCC3=C2CC[C@@H]4[C@@]3(C[C@@H]([C@@H](C4(C)C)O)O)C)C)C	C₃₁H₅₂O₃	472.7
-	2,3-Dideoxyfucose - C[C@@H]1[C@H](CC[C@@H](O1)O)O	C₆H₁₂O₃	132.16
-	1'-(3,5-dimethyl-1,2-oxazole-4-carbonyl)-N,N-dimethyl-1-oxo-2-propan-2-ylspiro[4H-isoquinoline-3,4'-piperidine]-4-carboxamide - CC1=C(C(=NO1)C)C(=O)N2CCC3(CC2)C(C4=CC=CC=C4C(=O)N3C(C)C)C(=O)N(C)C	C₂₅H₃₂N₄O₄	452.5
-	TG(i-15:0/i-19:0/a-15:0)[rac] - CCC(C)CCCCCCCCCCC(=O)OC[C@H](COC(=O)CCCCCCCCCCCC(C)C)OC(=O)CCCCCCCCCCCCCCCC(C)C	C₅₂H₁₀₀O₆	821.3
-	17-Methyl-nonadecanoic acid - CCC(C)CCCCCCCCCCCCCCCC(=O)O	C₂₀H₄₀O₂	312.5
-	2-(4-{[(2S,6'R)-7-chloro-4,6-dimethoxy-6'-methyl-2',3-dioxo-3H-spiro[1-benzofuran-2,1'-cyclohex[3]en]-4'-yl]amino}piperidin-1-yl)acetamide - C[C@@H]1CC(=CC(=O)[C@]12C(=O)C3=C(O2)C(=C(C=C3OC)OC)Cl)NC4CCN(CC4)CC(=O)N	C₂₃H₂₈ClN₃O₆	477.9