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. 2020 Aug 10;2020:5848497. doi: 10.1155/2020/5848497

Table 1.

Active compounds and ADME parameters of Sanhuang Xiexin decoction (SXD).

ID Name OB DL Source ID Name OB DL Source
MOL002235 Eupation 50.8 0.41 Dahuang MOL002908 5,8,2′-Trihydroxy-7-methoxyflavone 37.01 0.27 Huangqin
MOL002251 Mutatochrome 48.64 0.61 Dahuang MOL002909 5,7,2,5-Tetrahydroxy-8,6-dimethoxyflavone 33.82 0.45 Huangqin
MOL002259 Physciondiglucoside 41.65 0.63 Dahuang MOL002910 Carthamidin 41.15 0.24 Huangqin
MOL002260 Procyanidin B-5,3′-O-gallate 31.99 0.32 Dahuang MOL002911 2,6,2′,4′-Tetrahydroxy-6′-methoxychaleone 69.04 0.22 Huangqin
MOL002268 Rhein 47.07 0.28 Dahuang MOL002913 Dihydrobaicalin_qt 40.04 0.21 Huangqin
MOL002276 Sennoside E_qt 50.69 0.61 Dahuang MOL002914 Eriodyctiol (flavanone) 41.35 0.24 Huangqin
MOL002280 Torachrysone-8-O-beta-D-(6′-oxayl)-glucoside 43.02 0.74 Dahuang MOL002915 Salvigenin 49.07 0.33 Huangqin
MOL002281 Toralactone 46.46 0.24 Dahuang MOL002917 5,2′,6′-Trihydroxy-7,8-dimethoxyflavone 45.05 0.33 Huangqin
MOL002288 Emodin-1-O-beta-D-glucopyranoside 44.81 0.8 Dahuang MOL002925 5,7,2′,6′-Tetrahydroxyflavone 37.01 0.24 Huangqin
MOL002293 Sennoside D_qt 61.06 0.61 Dahuang MOL002926 Dihydrooroxylin A 38.72 0.23 Huangqin
MOL002297 Daucosterol_qt 35.89 0.7 Dahuang MOL002927 Skullcapflavone II 69.51 0.44 Huangqin
MOL002303 Palmidin A 32.45 0.65 Dahuang MOL002928 Oroxylin a 41.37 0.23 Huangqin
MOL000358 Beta-sitosterol 36.91 0.75 Dahuang MOL002932 Panicolin 76.26 0.29 Huangqin
MOL000471 Aloe-emodin 83.38 0.24 Dahuang MOL002933 5,7,4′-Trihydroxy-8-methoxyflavone 36.56 0.27 Huangqin
MOL000554 Gallic acid-3-O-(6'-O-galloyl)-glucoside 30.25 0.67 Dahuang MOL002934 Neobaicalein 104.34 0.44 Huangqin
MOL000096 (-)-Catechin 49.68 0.24 Dahuang MOL002937 Dihydrooroxylin 66.06 0.23 Huangqin
MOL001454 Berberine 36.86 0.78 Huanglian MOL000358 Beta-sitosterol 36.91 0.75 Huangqin
MOL013352 Obacunone 43.29 0.77 Huanglian MOL000359 Sitosterol 36.91 0.75 Huangqin
MOL002894 Berberrubine 35.74 0.73 Huanglian MOL000525 Norwogonin 39.4 0.21 Huangqin
MOL002897 Epiberberine 43.09 0.78 Huanglian MOL000552 5,2′-Dihydroxy-6,7,8-trimethoxyflavone 31.71 0.35 Huangqin
MOL002903 (R)-canadine 55.37 0.77 Huanglian MOL000073 Ent-epicatechin 48.96 0.24 Huangqin
MOL002904 Berlambine 36.68 0.82 Huanglian MOL000449 Stigmasterol 43.83 0.76 Huangqin
MOL002907 Corchoroside A_qt 104.95 0.78 Huanglian MOL001458 Coptisine 30.67 0.86 Huangqin
MOL000622 Magnograndiolide 63.71 0.19 Huanglian MOL001490 bis[(2S)-2-Ethylhexyl] benzene-1,2-dicarboxylate 43.59 0.35 Huangqin
MOL000762 Palmidin A 35.36 0.65 Huanglian MOL001506 Supraene 33.55 0.42 Huangqin
MOL000785 Palmatine 64.6 0.65 Huanglian MOL002879 Diop 43.59 0.39 Huangqin
MOL000098 Quercetin 46.43 0.28 Huanglian MOL002897 Epiberberine 43.09 0.78 Huangqin
MOL001458 Coptisine 30.67 0.86 Huanglian MOL008206 Moslosooflavone 44.09 0.25 Huangqin
MOL002668 Worenine 45.83 0.87 Huanglian MOL010415 11,13-Eicosadienoic acid, methyl ester 39.28 0.23 Huangqin
MOL008647 Moupinamide 86.71 0.26 Huanglian MOL012245 5,7,4′-Trihydroxy-6-methoxyflavanone 36.63 0.27 Huangqin
MOL001689 Acacetin 34.97 0.24 Huangqin MOL012246 5,7,4′-Trihydroxy-8-methoxyflavanone 74.24 0.26 Huangqin
MOL000173 Wogonin 30.68 0.23 Huangqin MOL012266 Rivularin 37.94 0.37 Huangqin
MOL000228 (2R)-7-Hydroxy-5-methoxy-2-phenylchroman-4-one 55.23 0.2 Huangqin MOL002935 Baicalin 29.53 0.77 Huangqin
MOL002714 Baicalein 33.52 0.21 Huangqin