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. 2022 Jul 18;10:e13737. doi: 10.7717/peerj.13737

Table 2. Thirty-five active ingredients of TM.

Herb id PubChem CID Active ingredients SwissADME
GI Lipinski Ghose Veber Egan Muegge
HBIN001773 5371272 1,6,6-Trimethyl-7-[(Z)-3-oxobut-1-enyl]-3,8-dioxatricyclo[5.1.0.02,4]octan-5-one High Yes Yes Yes Yes Yes
HBIN005643 7362 Furfural High Yes Yes Yes
HBIN006828 582907 2-t-Butyl-5-methyl-[1,3]dioxolane- 4-carboxylic acid High Yes Yes Yes Yes
HBIN008384 536539 1-(3,7,7-Trimethyl-4-bicyclo [4.1.0] hept-3-enyl)ethanone High Yes Yes Yes Yes
HBIN008798 1183 Vanillin High Yes Yes Yes
HBIN010490 19376246 Diacetone alcohol High Yes Yes Yes
HBIN010946 551125 5,10-Diethoxy-2,3,7,8-tetrahydro-1H, 6H-dipyrrolo[1,2-a:1′,2′-d]pyrazine High Yes Yes Yes Yes Yes
HBIN012161 538983 6-Acetyl-4,4,7-trimethylbicyclo[4.1.0] heptan-2-one High Yes Yes Yes Yes
HBIN016904 13864723 Arsanin High Yes Yes Yes Yes Yes
HBIN016938 101245659 Artecalin High Yes Yes Yes Yes Yes
HBIN017758 243 Benzoic acid High Yes Yes Yes
HBIN019298 689043 Caffeic acid High Yes Yes Yes Yes
HBIN023435 6713966 Austricin High Yes Yes Yes Yes Yes
HBIN025796 5281416 Esculetin High Yes Yes Yes
HBIN025897 5317238 Ethyl caffeate High Yes Yes Yes Yes Yes
HBIN025971 28310 Ethyl 4-hydroxyphenylacetate High Yes Yes Yes Yes
HBIN033339 5280934 Linolenic acid High Yes Yes
HBIN035129 689075 Methyl caffeate High Yes Yes Yes Yes
HBIN035816 518900 Methyl 4-hydroxyphenylacetate High Yes Yes Yes Yes
HBIN036159 11005 Myristic acid High Yes Yes Yes
HBIN038680 985 Palmitic acid High Yes Yes Yes
HBIN039500 999 Phenylacetic acid High Yes Yes Yes
HBIN039666 127 4-Hydroxyphenylacetic acid High Yes Yes Yes
HBIN039673 54675830 4-Hydroxybenzoate High Yes Yes Yes
HBIN039707 10394 3-(4-Hydroxyphenyl)propionic acid High Yes Yes Yes Yes
HBIN040911 8768 3,4-Dihydroxybenzaldehyde High Yes Yes Yes
HBIN041495 5280343 Quercetin High Yes Yes Yes Yes Yes
HBIN043442 5280460 Scopoletin High Yes Yes Yes Yes
HBIN044329 101702520 Sonchuside A High Yes Yes Yes Yes Yes
HBIN045261 443023 (+)-Syringaresinol High Yes Yes Yes Yes Yes
HBIN045547 5241825 Taraxacin High Yes Yes Yes Yes Yes
HBIN045548 9921439 Taraxinic acid High Yes Yes Yes Yes Yes
HBIN046806 5280535 p-Coumaryl alcohol High Yes Yes Yes
HBIN046808 641301 p-Coumaraldehyde High Yes Yes Yes
HBIN048047 54690394 D-Ascorbic acid High Yes Yes Yes