13 Known Ingredients in Total


Unique ingredients have been isolated from this plant.
Plant-Ingredients Associations were manually curated from publications or collected from other databases.



9 Ingredients with Available Activity


Unique ingredients have activity data available.


Ingredient Structrual Cards

Ingredient ID: NPC78326
Formula: C18H16O7

Ingredient ID: NPC69752
Formula: C20H20O7

Ingredient ID: NPC58156
Formula: C19H18O7

Ingredient ID: NPC55900
Formula: C18H16O8

Ingredient ID: NPC50898
Formula: C15H10O5

Ingredient ID: NPC50133
Formula: C21H22O8

Ingredient ID: NPC279989
Formula: C17H14O7

Ingredient ID: NPC266960
Formula: C17H14O7

Ingredient ID: NPC23694
Formula: C15H20O3

Ingredient ID: NPC183950
Formula: C16H12O6

Ingredient ID: NPC146679
Formula: C17H14O6

Ingredient ID: NPC103342
Formula: C16H12O6

Ingredient ID: NPC101830
Formula: C18H16O7

Properties

Ingredient ID Formulae Name MW AlogP MlogP XlogP # HBA # HBD PSA # Rotatable Bond # Ring # Heacy Atom Lipinski RO5 Violation
NPC101830 C18H16O7 Penduletin 344.09 -1.9197 2.67 1.882 2 2 94.45 9 3 25 0
NPC103342 C16H12O6 Isokaempferide 300.06 -2.2764 2.56 1.807 2 3 96.22 6 3 22 0
NPC146679 C17H14O6 Kumatakenin 314.08 -1.8679 2.67 2.326 2 2 85.22 7 3 23 0
NPC183950 C16H12O6 Chrysoeriol 300.06 -1.9363 2.56 1.123 1 3 96.22 6 3 22 0
NPC23694 C15H20O3 2-[(2R,4aS)-4a,8-dimethyl-7-oxo-1,2,3,4,5,6-hexahydronaphthalen-2-yl]prop-2-enoic acid 248.1412445 1.4294 2.78 1.972 3 1 54.37 2 2 18 0
NPC266960 C17H14O7 3,6-Dimethoxy Kaempferol 330.07 -2.3282 2.56 1.363 2 3 105.45 8 3 24 0
NPC279989 C17H14O7 3,3'-O-Dimethylquercetin 330.07 -2.3282 2.56 1.363 2 3 105.45 8 3 24 0
NPC50133 C21H22O8 3,5,6,7,8-pentamethoxy-2-(4-methoxyphenyl)chromen-4-one 402.1314677 -1.1545 2.89 2.476 2 0 81.68 7 3 29 0
NPC50898 C15H10O5 Apigenin 270.05 -1.8845 2.56 1.567 1 3 86.99 4 3 20 0
NPC55900 C18H16O8 5,7-dihydroxy-2-(4-hydroxy-3-methoxyphenyl)-3,6-dimethoxychromen-4-one 360.0845175 -2.38 2.56 0.919 2 3 114.68 4 3 26 0
NPC58156 C19H18O7 2-(4-hydroxyphenyl)-3,5,6,7-tetramethoxychromen-4-one 358.1052529 -1.5112 2.78 2.401 2 1 83.45 5 3 26 0
NPC69752 C20H20O7 3,5,6,7-Tetramethoxy-2-(4-Methoxyphenyl)Chromen-4-One 372.12 -1.1027 2.89 2.92 2 0 72.45 11 3 27 0
NPC78326 C18H16O7 Pachypodol 344.09 -1.9197 2.67 1.882 2 2 94.45 9 3 25 0

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1. General Information & structure data (InChi, InChiKey, SMILES)  
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