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CAS No.	英文名/中文名/SMILES	分子式	分子量
-	2-Methoxy-5-(1-phenylethenyl)benzene-1,4-diol - COC1=C(C=C(C(=C1)O)C(=C)C2=CC=CC=C2)O	C₁₅H₁₄O₃	242.27
-	(2-methylpropan-2-yl)oxycarbonyl (2S)-4-amino-2-[[(2R)-2-[[(2S)-1-[2-[(2-aminoacetyl)amino]-4-methylpentanoyl]pyrrolidine-2-carbonyl]amino]-3-sulfanylpropanoyl]amino]-4-oxobutanoate - CC(C)CC(C(=O)N1CCC[C@H]1C(=O)N[C@@H](CS)C(=O)N[C@@H](CC(=O)N)C(=O)OC(=O)OC(C)(C)C)NC(=O)CN	C₂₅H₄₂N₆O₉S	602.7
-	[5-ethenyl-1-oxo-6-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4,4a,5,6-tetrahydro-3H-pyrano[3,4-c]pyran-3-yl] (2E,6Z)-8-hydroxy-2,6-dimethylocta-2,6-dienoate - C/C(=C/CO)/CC/C=C(\C)/C(=O)OC1CC2C(C(OC=C2C(=O)O1)O[C@H]3[C@@H]([C@H]([C@@H]([C@H](O3)CO)O)O)O)C=C	C₂₆H₃₆O₁₂	540.6
-	1-[1-(1-Hydroxyheptadeca-9,12-dienoxy)-3-(1-hydroxyhexadecoxy)propan-2-yl]oxyoctadeca-9,12,15-trien-1-ol - CCCCCCCCCCCCCCCC(O)OCC(COC(CCCCCCCC=CCC=CCCCC)O)OC(CCCCCCCC=CCC=CCC=CCC)O	C₅₄H₁₀₀O₆	845.4
-	1-[(1S,2R,5S,6R,7R,18S)-7-(3-hydroxyphenyl)-2-[5-(5-prop-1-ynylthiophen-2-yl)thiophene-2-carbonyl]-6-tetracyclo[8.7.1.05,18.011,16]octadeca-10,12,14,16-tetraenyl]-2-methylguanidine - CC#CC1=CC=C(S1)C2=CC=C(S2)C(=O)[C@@H]3CC[C@H]4[C@@H]5[C@@H]3C=C6C=CC=CC6=C5CC[C@@H]([C@@H]4NC(=NC)N)C7=CC(=CC=C7)O	C₃₈H₃₇N₃O₂S₂	631.9
-	7-Methoxy-10-methyl-5,8-dioxo-1,2-dihydrophenanthrene-3-carbaldehyde - CC1=CC2=C(C3=C1CCC(=C3)C=O)C(=O)C=C(C2=O)OC	C₁₇H₁₄O₄	282.29
-	3-[3-(2-Carboxyethenyl)-4-nitrophenyl]prop-2-enoic acid - C1=CC(=C(C=C1C=CC(=O)O)C=CC(=O)O)[N+](=O)[O-]	C₁₂H₉NO₆	263.20
-	(1R,2'R,3'R,4R,12S,13R,21R,24R,25R,26R,29E,38R)-9,38-diamino-3'-[(2E,4E,7R)-1,7-dihydroxy-10-methyl-6-methylideneundeca-2,4,9-trien-2-yl]-2',4,21,26-tetrahydroxy-12-(4-hydroxyphenyl)-26,30-dimethylspiro[2,8,10,39-tetrazahexacyclo[31.7.1.115,19.04,13.024,29.037,41]dotetraconta-8,15,17,19(42),29,33(41),34,36-octaen-6-yne-25,1'-cyclopentane]-31,40-dione - C/C/1=C\2/CC[C@@]([C@@]3([C@@H]2CC[C@H](CC4=CC(=CC=C4)C[C@@H]5[C@H](CNC(=NC#CC[C@@]5(CN[C@@H]6C7=C(CC1=O)C=CC=C7[C@@H](NC6=O)N)O)N)C8=CC=C(C=C8)O)O)CC[C@@H]([C@H]3O)/C(=C\C=C\C(=C)[C@@H](CC=C(C)C)O)/CO)(C)O	C₆₃H₈₀N₆O₉	1065.3
-	[(1S,8S,9S,10S,13R)-6,9,10-trimethyl-4,14-dioxatetracyclo[7.5.0.01,13.03,7]tetradeca-3(7),5-dien-8-yl] 2-(hydroxymethyl)prop-2-enoate - C[C@H]1CC[C@@H]2[C@]3([C@@]1([C@@H](C4=C(C3)OC=C4C)OC(=O)C(=C)CO)C)O2	C₁₉H₂₄O₅	332.4
-	(3R,3aS,6R,6aS)-3,6-dimethyl-6-[(2S)-3-methyl-5-oxo-2H-furan-2-yl]-3a,4,5,6a-tetrahydro-3H-cyclopenta[b]furan-2-one - C[C@@H]1[C@@H]2CC[C@@]([C@H]2OC1=O)(C)[C@@H]3C(=CC(=O)O3)C	C₁₄H₁₈O₄	250.29