10 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: NPC77660
Formula: C21H20O11

Ingredient ID: NPC50898
Formula: C15H10O5

Ingredient ID: NPC279121
Formula: C15H10O6

Ingredient ID: NPC265547
Formula: C10H8O3

Ingredient ID: NPC256006
Formula: C21H20O10

Ingredient ID: NPC253662
Formula: C21H20O12

Ingredient ID: NPC20791
Formula: C15H10O7

Ingredient ID: NPC195986
Formula: C14H25NO

Ingredient ID: NPC195634
Formula: C10H10O3

Ingredient ID: NPC166189
Formula: C14H19NOS

Properties

Ingredient ID Formulae Name MW AlogP MlogP XlogP # HBA # HBD PSA # Rotatable Bond # Ring # Heacy Atom Lipinski RO5 Violation
NPC166189 C14H19NOS (2E,4E)-N-(2-methylpropyl)-6-thiophen-2-ylhexa-2,4-dienamide 249.1187352 1.7606 2.67 3.722 2 1 60.83 6 1 17 0
NPC195634 C10H10O3 7-methoxy-3,4-dihydrochromen-2-one 178.0629942 -0.0457 2.23 1.796 1 0 35.53 1 2 13 0
NPC195986 C14H25NO Pellitorin 223.19 0.5505 2.78 4.887 2 1 32.59 12 0 16 0
NPC20791 C15H10O7 Quercetin 302.04 -2.8012 2.34 1.381 2 5 127.45 6 3 22 0
NPC253662 C21H20O12 Miquelianin 464.1 -4.8921 2.45 -0.354 7 8 206.6 12 4 33 1
NPC256006 C21H20O10 5-hydroxy-2-(4-hydroxyphenyl)-7-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromen-4-one 432.1056468 -3.6314 2.67 0.459 6 6 166.14 4 4 31 1
NPC265547 C10H8O3 Herniarin 176.05 0.2182 2.23 2.051 1 0 35.53 2 2 13 0
NPC279121 C15H10O6 Luteolin 286.05 -2.3448 2.45 1.033 1 4 107.22 5 3 21 0
NPC50898 C15H10O5 Apigenin 270.05 -1.8845 2.56 1.567 1 3 86.99 4 3 20 0
NPC77660 C21H20O11 2-(3,4-Dihydroxyphenyl)-5-Hydroxy-7-[(2R,3R,4S,5S,6R)-3,4,5-Trihydroxy-6-(Hydroxymethyl)Oxan-2-Yl]Oxychromen-4-One 448.1 -4.0917 2.56 -0.075 6 7 186.37 11 4 32 1

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