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{"sheet":"Active compounds","index":0,"n_rows":166,"n_cols":5,"rows_kept":166,"merged":[[0,0,0,4]],"flags":["formulas_cached_only"]}
["Table S2. The information of 149 active compounds of 10 Chinese herbs in JDHXD."]
["Durg","Mol ID","Molecule Name","Oral Bioavailability（≥30%）"," Drug-Likeness(≥0.18)"]
["Hu Zhang","MOL013281","6,8-Dihydroxy-7-methoxyxanthone",35.83,0.21]
[null,"MOL013287","Physovenine",106.21,0.19]
[null,"MOL013288","Picralinal",58.01,0.75]
[null,"MOL002259","Physciondiglucoside",41.65,0.63]
[null,"MOL002268","rhein",47.07,0.28]
[null,"MOL002280","Torachrysone-8-O-beta-D-(6'-oxayl)-glucoside",43.02,0.74]
[null,"MOL000358","beta-sitosterol",36.91,0.75]
[null,"MOL000492","(+)-catechin",54.83,0.24]
[null,"MOL000006","luteolin",36.16,0.25]
[null,"MOL000098","quercetin",46.43,0.28]
[null,"MOL000472","Emodin",{"v":24.4,"d":"24.40"},0.24]
["Tufuling","MOL013117","4,7-Dihydroxy-5-methoxyl-6-methyl-8-formyl-flavan",37.03,0.28]
[null,"MOL013118","Neoastilbin",40.54,0.74]
[null,"MOL013119","Enhydrin",40.56,0.74]
[null,"MOL013129","(2R,3R)-2-(3,5-dihydroxyphenyl)-3,5,7-trihydroxychroman-4-one",63.17,0.27]
[null,"MOL001736","(-)-taxifolin",60.51,0.27]
[null,"MOL000358","beta-sitosterol",36.91,0.75]
[null,"MOL000359","sitosterol",36.91,0.75]
[null,"MOL004328","naringenin",59.29,0.21]
[null,"MOL000449","Stigmasterol",43.83,0.76]
[null,"MOL004567","isoengelitin",34.65,{"v":0.7,"d":"0.70"}]
[null,"MOL004575","astilbin",36.46,0.74]
[null,"MOL004576","taxifolin",57.84,0.27]
[null,"MOL004580","cis-Dihydroquercetin",66.44,0.27]
[null,"MOL000546","diosgenin",80.88,0.81]
[null,"MOL000098","quercetin",46.43,0.28]
[null,"MOL004568","Engelitin",36.27,{"v":0.7,"d":"0.70"}]
[null,"MOL000139","Smitilbin",{"v":37.6,"d":"37.60"},0.74]
[null,"MOL000472","Emodin",{"v":24.4,"d":"24.40"},0.24]
["Cheqianzi","MOL001663","(4aS,6aR,6aS,6bR,8aR,10R,12aR,14bS)-10-hydroxy-2,2,6a,6b,9,9,12a-heptamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylic acid",32.03,0.76]
[null,"MOL001735","Dinatin",30.97,0.27]
[null,"MOL000359","sitosterol",36.91,0.75]
[null,"MOL005869","daucostero_qt",36.91,0.75]
[null,"MOL007813","Dihydrotricetin",58.12,0.28]
[null,"MOL007819","Hypolaetin",33.24,0.28]
[null,"MOL007835","orobanchoside_qt",55.99,0.82]
[null,"MOL007836","plantaginin_qt",54.04,0.24]
[null,"MOL000098","quercetin",46.43,0.28]
[null,"MOL000449","Stigmasterol",43.83,0.76]
[null,"MOL004004","6-OH-Luteolin",46.93,0.28]
[null,"MOL001668","Geniposidic acid",19.59,0.41]
["Fenbixie","MOL013233","EINECS 213-897-0",71.96,0.72]
[null,"MOL000546","diosgenin",80.88,0.81]
[null,"MOL001215","tirucallol",42.12,0.75]
[null,"MOL001255","Boswellic acid",39.55,0.75]
["Shichangpu","MOL003542","8-Isopentenyl-kaempferol",38.04,0.39]
[null,"MOL003576","(1R,3aS,4R,6aS)-1,4-bis(3,4-dimethoxyphenyl)-1,3,3a,4,6,6a-hexahydrofuro[4,3-c]furan",52.35,0.62]
[null,"MOL003578","Cycloartenol",38.69,0.78]
[null,"MOL000422","kaempferol",41.88,0.24]
[null,"MOL000472","Emodin",{"v":24.4,"d":"24.40"},0.24]
["Wangbuliuxing","MOL000449","Stigmasterol",43.83,0.76]
[null,"MOL002322","isovitexin",31.29,0.72]
[null,"MOL008908","(3S,6S,9S,12S)-6-(1H-indol-3-ylmethyl)-12-isopropyl-3,9-dimethyl-1,4,7,10,13-pentazacyclopentadecane-2,5,8,11,14-pentone",33.27,0.78]
[null,"MOL000098","quercetin",46.43,0.28]
[null,"MOL008910","vaccarin",4.48,0.32]
["Ezhu","MOL000296","hederagenin",36.91,0.75]
[null,"MOL000906","wenjine",47.93,0.27]
[null,"MOL000940","bisdemethoxycurcumin",77.38,0.26]
[null,"MOL007743","Pinostrobin",41.92,{"v":0.2,"d":"0.20"}]
[null,"MOL002844","Pinocembrin",64.72,0.18]
[null,"MOL000229","cardamomin",68.96,0.16]
["Chuanniuxi","MOL012286","Betavulgarin",68.75,0.39]
[null,"MOL012298","Rubrosterone",32.69,0.47]
[null,"MOL000358","beta-sitosterol",36.91,0.75]
[null,"MOL000098","quercetin",46.43,0.28]
[null,"MOL000433","Folic Acid",68.96,0.71]
[null,"MOL012288","Cyasterone",{"v":11.2,"d":"11.20"},0.82]
["Yuanzhi","MOL002140","Perlolyrine",65.95,0.27]
[null,"MOL003370","Onjixanthone I",79.16,{"v":0.3,"d":"0.30"}]
[null,"MOL013171","1,6-Dihydroxy-3,7-dimethoxyxanthone",89.65,0.27]
[null,"MOL003152","Gentisin",64.06,0.21]
[null,"MOL006844","Norharman",18.88,0.08]
["Gancao","MOL001484","Inermine",75.18,0.54]
[null,"MOL001792","DFV",32.76,0.18]
[null,"MOL000211","Mairin",55.38,0.78]
[null,"MOL002311","Glycyrol",90.78,0.67]
[null,"MOL000239","Jaranol",50.83,0.29]
[null,"MOL002565","Medicarpin",49.22,0.34]
[null,"MOL000354","isorhamnetin",{"v":49.6,"d":"49.60"},0.31]
[null,"MOL000359","sitosterol",36.91,0.75]
[null,"MOL003656","Lupiwighteone",51.64,0.37]
[null,"MOL003896","7-Methoxy-2-methyl isoflavone",42.56,{"v":0.2,"d":"0.20"}]
[null,"MOL000392","formononetin",69.67,0.21]
[null,"MOL000417","Calycosin",47.75,0.24]
[null,"MOL000422","kaempferol",41.88,0.24]
[null,"MOL004328","naringenin",59.29,0.21]
[null,"MOL004805","(2S)-2-[4-hydroxy-3-(3-methylbut-2-enyl)phenyl]-8,8-dimethyl-2,3-dihydropyrano[2,3-f]chromen-4-one",31.79,0.72]
[null,"MOL004806","euchrenone",30.29,0.57]
[null,"MOL004808","glyasperin B",65.22,0.44]
[null,"MOL004810","glyasperin F",75.84,0.54]
[null,"MOL004811","Glyasperin C",45.56,{"v":0.4,"d":"0.40"}]
[null,"MOL004814","Isotrifoliol",31.94,0.42]
[null,"MOL004815","(E)-1-(2,4-dihydroxyphenyl)-3-(2,2-dimethylchromen-6-yl)prop-2-en-1-one",39.62,0.35]
[null,"MOL004820","kanzonols W",50.48,0.52]
[null,"MOL004824","(2S)-6-(2,4-dihydroxyphenyl)-2-(2-hydroxypropan-2-yl)-4-methoxy-2,3-dihydrofuro[3,2-g]chromen-7-one",60.25,0.63]
[null,"MOL004827","Semilicoisoflavone B",48.78,0.55]
[null,"MOL004828","Glepidotin A",44.72,0.35]
[null,"MOL004829","Glepidotin B",64.46,0.34]
[null,"MOL004833","Phaseolinisoflavan",32.01,0.45]
[null,"MOL004835","Glypallichalcone",{"v":61.6,"d":"61.60"},0.19]
[null,"MOL004838","8-(6-hydroxy-2-benzofuranyl)-2,2-dimethyl-5-chromenol",58.44,0.38]
[null,"MOL004841","Licochalcone B",76.76,0.19]
[null,"MOL004848","licochalcone G",49.25,0.32]
[null,"MOL004849","3-(2,4-dihydroxyphenyl)-8-(1,1-dimethylprop-2-enyl)-7-hydroxy-5-methoxy-coumarin",59.62,0.43]
[null,"MOL004855","Licoricone",63.58,0.47]
[null,"MOL004856","Gancaonin A",51.08,{"v":0.4,"d":"0.40"}]
[null,"MOL004857","Gancaonin B",48.79,0.45]
[null,"MOL004860","licorice glycoside E",32.89,0.27]
[null,"MOL004863","3-(3,4-dihydroxyphenyl)-5,7-dihydroxy-8-(3-methylbut-2-enyl)chromone",66.37,0.41]
[null,"MOL004864","5,7-dihydroxy-3-(4-methoxyphenyl)-8-(3-methylbut-2-enyl)chromone",30.49,0.41]
[null,"MOL004866","2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-6-(3-methylbut-2-enyl)chromone",44.15,0.41]
[null,"MOL004879","Glycyrin",52.61,0.47]
[null,"MOL004882","Licocoumarone",33.21,0.36]
[null,"MOL004883","Licoisoflavone",41.61,0.42]
[null,"MOL004884","Licoisoflavone B",38.93,0.55]
[null,"MOL004885","licoisoflavanone",52.47,0.54]
[null,"MOL004891","shinpterocarpin",{"v":80.3,"d":"80.30"},0.73]
[null,"MOL004898","(E)-3-[3,4-dihydroxy-5-(3-methylbut-2-enyl)phenyl]-1-(2,4-dihydroxyphenyl)prop-2-en-1-one",46.27,0.31]
[null,"MOL004903","liquiritin",65.69,0.74]
[null,"MOL004904","licopyranocoumarin",80.36,0.65]
[null,"MOL004905","3,22-Dihydroxy-11-oxo-delta(12)-oleanene-27-alpha-methoxycarbonyl-29-oic acid",34.32,0.55]
[null,"MOL004907","Glyzaglabrin",61.07,0.35]
[null,"MOL004908","Glabridin",53.25,0.47]
[null,"MOL004910","Glabranin",{"v":52.9,"d":"52.90"},0.31]
[null,"MOL004911","Glabrene",46.27,0.44]
[null,"MOL004912","Glabrone",52.51,{"v":0.5,"d":"0.50"}]
[null,"MOL004913","1,3-dihydroxy-9-methoxy-6-benzofurano[3,2-c]chromenone",48.14,0.43]
[null,"MOL004914","1,3-dihydroxy-8,9-dimethoxy-6-benzofurano[3,2-c]chromenone",{"v":62.9,"d":"62.90"},0.53]
[null,"MOL004915","Eurycarpin A",43.28,0.37]
[null,"MOL004917","glycyroside",37.25,0.79]
[null,"MOL004924","(-)-Medicocarpin",40.99,0.95]
[null,"MOL004935","Sigmoidin-B",34.88,0.41]
[null,"MOL004941","(2R)-7-hydroxy-2-(4-hydroxyphenyl)chroman-4-one",71.12,0.18]
[null,"MOL004945","(2S)-7-hydroxy-2-(4-hydroxyphenyl)-8-(3-methylbut-2-enyl)chroman-4-one",36.57,0.32]
[null,"MOL004948","Isoglycyrol",{"v":44.7,"d":"44.70"},0.84]
[null,"MOL004949","Isolicoflavonol",45.17,0.42]
[null,"MOL004957","HMO",38.37,0.21]
[null,"MOL004959","1-Methoxyphaseollidin",69.98,0.64]
[null,"MOL004961","Quercetin der.",46.45,0.33]
[null,"MOL004966","3'-Hydroxy-4'-O-Methylglabridin",43.71,0.57]
[null,"MOL000497","licochalcone a",40.79,0.29]
[null,"MOL004974","3'-Methoxyglabridin",46.16,0.57]
[null,"MOL004978","2-[(3R)-8,8-dimethyl-3,4-dihydro-2H-pyrano[6,5-f]chromen-3-yl]-5-methoxyphenol",36.21,0.52]
[null,"MOL004980","Inflacoumarin A",39.71,0.33]
[null,"MOL004985","icos-5-enoic acid",{"v":30.7,"d":"30.70"},{"v":0.2,"d":"0.20"}]
[null,"MOL004988","Kanzonol F",32.47,0.89]
[null,"MOL004989","6-prenylated eriodictyol",39.22,0.41]
[null,"MOL004990","7,2',4'-trihydroxy－5-methoxy-3－arylcoumarin",83.71,0.27]
[null,"MOL004991","7-Acetoxy-2-methylisoflavone",38.92,0.26]
[null,"MOL004993","8-prenylated eriodictyol",53.79,{"v":0.4,"d":"0.40"}]
[null,"MOL004996","gadelaidic acid",{"v":30.7,"d":"30.70"},{"v":0.2,"d":"0.20"}]
[null,"MOL000500","Vestitol",74.66,0.21]
[null,"MOL005000","Gancaonin G",60.44,0.39]
[null,"MOL005001","Gancaonin H",{"v":50.1,"d":"50.10"},0.78]
[null,"MOL005003","Licoagrocarpin",58.81,0.58]
[null,"MOL005007","Glyasperins M",72.67,0.59]
[null,"MOL005008","Glycyrrhiza flavonol A",41.28,{"v":0.6,"d":"0.60"}]
[null,"MOL005012","Licoagroisoflavone",57.28,0.49]
[null,"MOL005013","18α-hydroxyglycyrrhetic acid",41.16,0.71]
[null,"MOL005016","Odoratin",49.95,{"v":0.3,"d":"0.30"}]
[null,"MOL005017","Phaseol",78.77,0.58]
[null,"MOL005018","Xambioona",54.85,0.87]
[null,"MOL005020","dehydroglyasperins C",53.82,0.37]
[null,"MOL000098","quercetin",46.43,0.28]

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[{"$nulls":5},"HSP90AA1"]
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[{"$nulls":5},"PRKACA"]
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[{"$nulls":5},"NOS3"]
[{"$nulls":5},"EGFR"]
[{"$nulls":5},"FOS"]
[{"$nulls":5},"MMP2"]
[{"$nulls":5},"MMP9"]
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[{"$nulls":5},"CDKN2A"]
[{"$nulls":5},"ELK1"]
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[{"$nulls":5},"RAF1"]
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[{"$nulls":5},"ERBB2"]
[{"$nulls":5},"HMOX1"]
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[{"$nulls":5},"IGFBP3"]
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[{"$nulls":5},"NFKB2"]
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[{"$nulls":5},"KDR"]
[{"$nulls":5},"ADRA1D"]
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[{"$nulls":5},"MAPK8"]
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[{"$nulls":5},"CYP2D6"]
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[{"$nulls":5},"FLT1"]
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[{"$nulls":5},"PRKCD"]
[{"$nulls":5},"CSF2"]
[{"$nulls":5},"BTK"]
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[{"$nulls":5},"MAPK10"]
[{"$nulls":5},"IL4"]
[{"$nulls":5},"SIRT1"]
[{"$nulls":5},"HSD3B2"]
[{"$nulls":5},"STAT3"]
[{"$nulls":5},"CDK4"]
[{"$nulls":5},"ACPP"]
[{"$nulls":5},"LGALS3"]
[{"$nulls":5},"PCNA"]
[{"$nulls":5},"CASP7"]
[{"$nulls":5},"MET"]

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{"sheet":"Sheet5","index":4,"n_rows":8,"n_cols":1,"rows_kept":8,"flags":["formulas_cached_only"]}
["MOL000358"]
["MOL000098"]
["MOL000472"]
["MOL000359"]
["MOL004328"]
["MOL000449"]
["MOL000546"]
["MOL000422"]