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.



7 Ingredients with Available Activity


Unique ingredients have activity data available.


Ingredient Structrual Cards

Ingredient ID: NPC9609
Formula: C18H16O8

Ingredient ID: NPC93376
Formula: C18H16O8

Ingredient ID: NPC78129
Formula: C18H16O11S

Ingredient ID: NPC45522
Formula: C22H22O13

Ingredient ID: NPC42773
Formula: C22H22O13

Ingredient ID: NPC256283
Formula: C17H14O7

Ingredient ID: NPC25495
Formula: C19H18O8

Ingredient ID: NPC244964
Formula: C16H12O11S

Ingredient ID: NPC241498
Formula: C16H12O6

Ingredient ID: NPC202224
Formula: C23H24O13

Ingredient ID: NPC176300
Formula: C20H20O8

Ingredient ID: NPC160951
Formula: C18H16O7

Ingredient ID: NPC145379
Formula: C18H16O6

Properties

Ingredient ID Formulae Name MW AlogP MlogP XlogP # HBA # HBD PSA # Rotatable Bond # Ring # Heacy Atom Lipinski RO5 Violation
NPC145379 C18H16O6 328.0946882 -1.1193 2.78 2.161 1 1 74.22 8 3 24 0
NPC160951 C18H16O7 Eupatorin 344.09 -1.5796 2.67 1.198 1 2 94.45 9 3 25 0
NPC176300 C20H20O8 Artemetin 388.12 -1.563 2.78 1.957 2 1 92.68 12 3 28 0
NPC202224 C23H24O13 508.1216908 -4.5354 2.56 -0.279 13 7 204.83 6 4 36 1
NPC241498 C16H12O6 Hispidulin 300.06 -1.9363 2.56 1.123 1 3 96.22 6 3 22 0
NPC244964 C16H12O11S 411.0022072 -3.5796 1.9 -1.338 11 4 191.26 4 3 28 0
NPC25495 C19H18O8 Casticin 374.1 -1.9715 2.67 1.438 2 2 103.68 11 3 27 0
NPC256283 C17H14O7 5,7-Dihydroxy-2-(3-Hydroxy-4-Methoxyphenyl)-6-Methoxychromen-4-One 330.07 -1.9881 2.56 0.679 1 3 105.45 8 3 24 0
NPC42773 C22H22O13 494.11 -4.9439 2.45 -0.798 7 8 215.83 14 4 35 1
NPC45522 C22H22O13 494.1060408 -4.9439 2.45 -0.798 13 8 215.83 14 4 35 1
NPC78129 C18H16O11S 439.0335073 -2.7626 2.12 -0.729 11 2 169.26 6 3 30 0
NPC93376 C18H16O8 3,5-Dihydroxy-2-(3-Hydroxy-4-Methoxyphenyl)-6,7-Dimethoxychromen-4-One 360.08 -2.036 2.56 1.546 2 3 114.68 10 3 26 0
NPC9609 C18H16O8 Centaureidin 360.08 -2.38 2.56 0.919 2 3 114.68 10 3 26 0

Download Data

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1. General Information & structure data (InChi, InChiKey, SMILES)  
2. Physico-chemical Properties