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CAS No.	英文名/中文名/SMILES	分子式	分子量
-	(2R)-2-[3-(4-bromophenoxy)-2-methyl-4-oxochromen-7-yl]oxypropanoic acid - CC1=C(C(=O)C2=C(O1)C=C(C=C2)O[C@H](C)C(=O)O)OC3=CC=C(C=C3)Br	C₁₉H₁₅BRO₆	419.2
-	(3S,5S,8R,9S,10R,13R,14R,17S)-10,13-dimethyl-17-(2-phenylethynyl)-1,2,3,4,5,6,7,8,9,11,12,14,15,16-tetradecahydrocyclopenta[a]phenanthrene-3,17-diol - C[C@@]12CC[C@@H](C[C@@H]1CC[C@@H]3[C@@H]2CC[C@@]4([C@@H]3CC[C@]4(C#CC5=CC=CC=C5)O)C)O	C₂₇H₃₆O₂	392.6
-	1-[(7R,8aR)-1'-ethyl-7-hydroxyspiro[1,3,6,7,8,8a-hexahydropyrrolo[1,2-a]pyrazine-4,3'-azetidine]-2-yl]ethanone - CCN1CC2(C1)CN(C[C@@H]3N2C[C@@H](C3)O)C(=O)C	C₁₃H₂₃N₃O₂	253.34
-	N-[(Z)-[(8R,9R,13R,14R)-3-hydroxy-13-methyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-17-ylidene]amino]octanamide - CCCCCCCC(=O)N/N=C\1/CC[C@H]2[C@]1(CC[C@@H]3[C@H]2CCC4=C3C=CC(=C4)O)C	C₂₆H₃₈N₂O₂	410.6
-	2-Hydroxy-7-methoxy-1,1,4a-trimethyl-7-propan-2-yl-2,3,4,4b,5,6,10,10a-octahydrophenanthren-9-one - CC(C)C1(CCC2C(=C1)C(=O)CC3C2(CCC(C3(C)C)O)C)OC	C₂₁H₃₄O₃	334.5
-	[(1S,2Z,4S,8R,9R,11S)-1-hydroxy-2-(hydroxymethyl)-11-methyl-7-methylidene-6-oxo-5,14-dioxatricyclo[9.2.1.04,8]tetradeca-2,12-dien-9-yl] (Z)-2-methylbut-2-enoate - C/C=C(/C)\C(=O)O[C@@H]1C[C@]2(C=C[C@](O2)(/C(=C\[C@H]3[C@@H]1C(=C)C(=O)O3)/CO)O)C	C₂₀H₂₄O₇	376.4
49751-82-8	(1R,2S,5R)-6,6-dimethylbicyclo[3.1.1]heptane-2-carbaldehyde - CC1([C@@H]2CC[C@@H]([C@H]1C2)C=O)C	C₁₀H₁₆O	152.23
-	7-hydroxy-5-methoxy-4-methyl-6-(3-methyl-6-morpholin-4-yl-6-oxohex-2-enyl)-3H-2-benzofuran-1-one - CC1=C2COC(=O)C2=C(C(=C1OC)CC=C(C)CCC(=O)N3CCOCC3)O	C₂₁H₂₇NO₆	389.4
-	N-[(3S,6S,7R,10S,15R)-15-benzyl-10-[(2S)-butan-2-yl]-7,13,13-trimethyl-2,5,9,12,14-pentaoxo-3-propan-2-yl-1,4,8,11-tetraoxacyclopentadec-6-yl]-3-formamido-2-hydroxybenzamide - CC[C@H](C)[C@H]1C(=O)O[C@@H]([C@@H](C(=O)O[C@H](C(=O)O[C@@H](C(=O)C(C(=O)O1)(C)C)CC2=CC=CC=C2)C(C)C)NC(=O)C3=C(C(=CC=C3)NC=O)O)C	C₃₆H₄₄N₂O₁₂	696.7
-	2-[(4S)-4-hydroxy-3,6-dioxodioxan-4-yl]acetic acid - C1C(=O)OOC(=O)[C@@]1(CC(=O)O)O	C₆H₆O₇	190.11