Table 2 Active ingredients and parameters of THSWD
From: Traditional Chinese Medicine for adjuvant treatment of breast cancer: Taohong Siwu Decoction
Pubchem CID | Abbreviation | Compound | OB (%) | DL | Herb |
|---|---|---|---|---|---|
64971 | BS1 | Mairin | 55.38 | 0.78 | BS |
442534 | BS2 | Paeoniflorin | 53.87 | − 1.47 | BS |
11092 | BS3 | Paeonol | 28.79 | 0.04 | BS |
338 | BS4 | Salicylic acid | 32.13 | 0.03 | BS |
370 | BS5 | Gallic acid | 31.69 | 0.04 | BS |
9064 | BS6 | (+)-catechin | 54.83 | 0.24 | BS |
70698143 | BS7 | Paeoniflorgenone | 87.59 | 0.37 | BS |
9,841735 | BS8 | Palbinone | 43.56 | 0.53 | BS |
5282184 | CX1 | Mandenol | 42 | 0.19 | CX |
161748 | CX2 | Myricanone | 40.6 | 0.51 | CX |
160179 | CX3 | Perlolyrine | 65.95 | 0.27 | CX |
91726743 | CX4 | Senkyunone | 47.66 | 0.24 | CX |
10873344 | CX5 | Wallichilide | 42.31 | 0.71 | CX |
3085257 | CX6 | Senkyunolide A | 26.56 | 0.07 | CX |
135398658 | CX7 | FA | 68.96 | 0.71 | CX |
222284 | B1 | Sitosterol | 36.91 | 0.75 | CX; BS; DH |
5319022 | A1 | (Z)-Ligustilide | 53.72 | 0.07 | CX; DG |
689043 | A2 | Caffeic acid | 25.76 | 0.05 | CX; DG |
1548883 | A3 | FERULIC ACID (CIS) | 54.97 | 0.06 | CX; DG |
237332 | SD1 | 5-Hydroxymethylfurfural | 45.07 | 0.02 | DH |
5281605 | HH1 | Baicalein | 33.52 | 0.21 | HH |
5280489 | HH2 | Beta-carotene | 37.18 | 0.58 | HH |
5597 | HH3 | CLR | 37.87 | 0.68 | HH |
5281238 | HH4 | Flavoxanthin | 60.41 | 0.56 | HH |
261166 | HH5 | Lignan | 43.32 | 0.65 | HH |
161739 | HH6 | Lupeol-palmitate | 33.98 | 0.32 | HH |
5280784 | HH7 | Phytoene | 39.56 | 0.5 | HH |
643672 | HH8 | Phytofluene | 43.18 | 0.5 | HH |
457801 | HH9 | Poriferast-5-en-3beta-ol | 36.91 | 0.75 | HH |
5281555 | HH10 | Pyrethrin II | 48.36 | 0.35 | HH |
6443665 | HH11 | Hydroxysafflor yellow A | 3.53 | 0.68 | HH |
5280445 | HH12 | Luteolin | 36.16 | 0.25 | HH |
10237057 | HH13 | 4-[(E)-4-(3,5-dimethoxy-4-oxo-1-cyclohexa-2,5-dienylidene but-2-enylidene]-2,6-dimethoxycyclohexa-2,5-dien-1-one | 48.47 | 0.36 | HH |
5,281638 | HH14 | 6-hydroxykaempferol | 62.13 | 0.27 | HH |
5281680 | HH15 | Quercetagetin | 45.01 | 0.31 | HH |
21786815 | HH16 | 7,8-dimethyl-1H-pyrimido[5,6-g] quinoxaline-2,4-dione | 45.75 | 0.19 | HH |
64982 | HH17 | Baicalin | 40.12 | 0.75 | HH |
5280863 | C1 | Kaempferol | 41.88 | 0.26 | HH; BS |
5280794 | D1 | Stigmasterol | 43.83 | 0.76 | HH; DG; DH |
5280343 | E1 | Quercetin | 46.43 | 0.28 | HH; TR |
1794427 | E2 | Chlorogenic acid | 11.93 | 0.33 | HH; TR |
5281800 | SD2 | Acteoside | 2.94 | − 1.89 | DH |
91520 | SD3 | Catalpol | 5.07 | − 1.72 | DH |
656516 | TR1 | Amygdalin | 4.42 | − 1.91 | TR |
173283 | TR2 | Campesterol | 37.58 | 0.71 | TR |
25245018 | TR3 | GA120 | 84.85 | 0.45 | TR |
73299 | TR4 | Hederagenin | 36.91 | 0.75 | TR |
92735 | TR5 | Populoside_qt | 108.89 | 0.2 | TR |
9548595 | TR6 | Sitosterol alpha1 | 43.28 | 0.78 | TR |
91747858 | TR7 | 2,3-didehydro GA77 | 88.08 | 0.53 | TR |
91747861 | TR8 | GA121-isolactone | 72.7 | 0.54 | TR |
91747856 | TR9 | GA122-isolactone | 88.11 | 0.54 | TR |
5460209 | TR10 | GA19 | 88.6 | 0.46 | TR |
5460372 | TR11 | Gibberellin A44 | 101.61 | 0.54 | TR |
12310181 | TR12 | GA54 | 64.21 | 0.53 | TR |
13071237 | TR13 | GA60 | 93.17 | 0.53 | TR |
14160551 | TR14 | GA63 | 65.54 | 0.54 | TR |
5460657 | TR15 | Gibberellin 7 | 73.8 | 0.5 | TR |
131752128 | TR16 | GA77 | 87.89 | 0.53 | TR |
131752584 | TR17 | GA87 | 68.85 | 0.57 | TR |
9945785 | TR18 | 3-O-p-coumaroylquinic acid | 37.63 | 0.29 | TR |
222284 | F1 | Beta-sitosterol | 36.91 | 0.75 | TR; HH; DG; BS |