11 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.



6 Ingredients with Available Activity


Unique ingredients have activity data available.


Ingredient Structrual Cards

Ingredient ID: NPC97119
Formula: C35H28O20

Ingredient ID: NPC54802
Formula: C20H18O10

Ingredient ID: NPC44260
Formula: C27H24O18

Ingredient ID: NPC281131
Formula: C21H20O12

Ingredient ID: NPC264145
Formula: C8H8O5

Ingredient ID: NPC253521
Formula: C28H24O16

Ingredient ID: NPC176362
Formula: C35H28O20

Ingredient ID: NPC173637
Formula: C21H20O11

Ingredient ID: NPC144097
Formula: C27H22O15

Ingredient ID: NPC111929
Formula: C21H20O10

Ingredient ID: NPC104222
Formula: C41H32O26

Properties

Ingredient ID Formulae Name MW AlogP MlogP XlogP # HBA # HBD PSA # Rotatable Bond # Ring # Heacy Atom Lipinski RO5 Violation
NPC104222 C41H32O26 Pentagalloyl Glucose 940.12 -7.5719 3.11 0.697 11 15 444.18 31 6 67 3
NPC111929 C21H20O10 Afzelin 432.11 -3.9318 2.67 0.883 6 6 166.14 10 4 31 1
NPC144097 C27H22O15 586.09587 -5.3931 2.78 0.282 15 9 253.13 15 5 42 1
NPC173637 C21H20O11 Quercitrin 448.1 -4.3921 2.56 0.349 6 7 186.37 11 4 32 1
NPC176362 C35H28O20 768.1173933 -6.9155 3.11 0.432 9 12 340.12 10 6 55 1
NPC253521 C28H24O16 616.1064347 -5.9038 2.78 0.039 16 10 273.36 17 5 44 1
NPC264145 C8H8O5 Gallic Acid Methyl Ester 184.04 -1.3697 1.79 0.323 2 3 86.99 6 1 13 0
NPC281131 C21H20O12 Hyperoside 464.1 -4.8921 2.45 -0.354 7 8 206.6 12 4 33 1
NPC44260 C27H24O18 1,2,6-Tri-O-Galloyl-Beta-D-Glucose 636.1 -5.5485 2.45 -0.518 9 11 310.66 21 4 45 1
NPC54802 C20H18O10 418.0899968 -3.9211 2.56 0.423 10 6 166.14 9 4 30 1
NPC97119 C35H28O20 768.1173933 -6.9155 3.11 0.432 20 12 340.12 22 6 55 1

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