24 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.



8 Ingredients with Available Activity


Unique ingredients have activity data available.


Ingredient Structrual Cards

Ingredient ID: NPC98477
Formula: C14H20O8

Ingredient ID: NPC73855
Formula: C21H20O12

Ingredient ID: NPC65391
Formula: C10H12ClNO4

Ingredient ID: NPC41493
Formula: C21H18O13

Ingredient ID: NPC35644
Formula: C31H28O7

Ingredient ID: NPC312391
Formula: C16H14O4

Ingredient ID: NPC282720
Formula: C26H32O14

Ingredient ID: NPC275760
Formula: C10H13NO4

Ingredient ID: NPC240431
Formula: C21H20O13

Ingredient ID: NPC227768
Formula: C46H52O24

Ingredient ID: NPC217387
Formula: C28H24O16

Ingredient ID: NPC213322
Formula: C16H14O4

Ingredient ID: NPC20791
Formula: C15H10O7

Ingredient ID: NPC173637
Formula: C21H20O11

Ingredient ID: NPC169749
Formula: C15H10O8

Ingredient ID: NPC169468
Formula: C19H30O8

Ingredient ID: NPC138927
Formula: C21H18O14

Ingredient ID: NPC119056
Formula: C31H28O7

Ingredient ID: NPC116775
Formula: C15H10O6

Ingredient ID: NPC113783
Formula: C10H10ClNO3

Ingredient ID: NPC111929
Formula: C21H20O10

Ingredient ID: NPC110879
Formula: C19H30O8

Ingredient ID: NPC107263
Formula: C28H24O16

Ingredient ID: NPC101426
Formula: C21H20O12

Properties

Ingredient ID Formulae Name MW AlogP MlogP XlogP # HBA # HBD PSA # Rotatable Bond # Ring # Heacy Atom Lipinski RO5 Violation
NPC101426 C21H20O12 5,6,7,8-tetrahydroxy-2-(4-hydroxyphenyl)-3-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxychromen-4-one 464.0954761 -4.8524 2.45 0.244 6 8 206.6 3 4 33 1
NPC107263 C28H24O16 [(2R,3S,4S,5R,6S)-6-[2-(3,4-dihydroxyphenyl)-3,5-dihydroxy-4-oxochromen-7-yl]oxy-3,4,5-trihydroxyoxan-2-yl]methyl 3,4,5-trihydroxybenzoate 616.1064347 -5.5598 2.78 0.666 8 10 273.36 7 5 44 1
NPC110879 C19H30O8 386.1940679 -1.1243 2.67 1.223 8 5 136.68 4 2 27 0
NPC111929 C21H20O10 Afzelin 432.11 -3.9318 2.67 0.883 6 6 166.14 10 4 31 1
NPC113783 C10H10ClNO3 3-chloro-4-hydroxy-7-(2-methylprop-1-enyl)-1H-azepine-2,5-dione 227.0349209 0.8453 2.01 1.54 4 2 66.4 1 1 15 0
NPC116775 C15H10O6 Kaempferol 286.05 -2.3409 2.45 1.915 2 4 107.22 5 3 21 0
NPC119056 C31H28O7 512.1835032 -0.9765 4.1 6.084 1 4 116.45 5 5 38 1
NPC138927 C21H18O14 Myricetin-3-O-Beta-D-Glucuronide 494.07 -5.2502 2.23 -0.731 8 9 243.9 13 4 35 1
NPC169468 C19H30O8 386.1940679 -0.991 2.67 -0.464 8 5 136.68 14 2 27 0
NPC169749 C15H10O8 Myricetin 318.04 -3.2615 2.23 0.847 2 6 147.68 7 3 23 1
NPC173637 C21H20O11 Quercitrin 448.1 -4.3921 2.56 0.349 6 7 186.37 11 4 32 1
NPC20791 C15H10O7 Quercetin 302.04 -2.8012 2.34 1.381 2 5 127.45 6 3 22 0
NPC213322 C16H14O4 270.0892089 -0.7121 2.78 2.605 1 2 66.76 4 3 20 0
NPC217387 C28H24O16 616.1064347 -5.8641 2.78 0.208 16 10 273.36 17 5 44 1
NPC227768 C46H52O24 988.2848525 -1.1943 3.88 3.91 21 0 307.76 27 4 70 2
NPC240431 C21H20O13 Isomyricitrin 480.09 -5.3524 2.34 -0.888 7 9 226.83 13 4 34 1
NPC275760 C10H13NO4 4-hydroxy-7-(2-hydroxy-2-methylpropyl)-1H-azepine-2,5-dione 211.0844579 -0.4369 2.01 0.388 5 3 90.12 2 1 15 0
NPC282720 C26H32O14 [2,6-dihydroxy-3-methyl-5-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]-4-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]-phenylmethanone 568.1792057 -4.9853 2.78 -0.058 11 10 247.06 7 4 40 2
NPC312391 C16H14O4 270.0892089 -0.7121 2.78 2.605 1 2 66.76 4 3 20 0
NPC35644 C31H28O7 512.1835032 -0.9765 4.1 6.084 1 4 116.45 5 5 38 1
NPC41493 C21H18O13 (2S,3S,4S,5R,6S)-6-[6-(5,7-dihydroxy-4-oxochromen-2-yl)-2,3-dihydroxyphenoxy]-3,4,5-trihydroxyoxane-2-carboxylic acid 478.0747406 -4.4498 2.34 -0.881 7 8 223.67 4 4 34 1
NPC65391 C10H12ClNO4 3-chloro-4-hydroxy-7-(2-hydroxy-2-methylpropyl)-1H-azepine-2,5-dione 245.0454855 -0.5147 1.9 1.089 5 3 86.63 2 1 16 0
NPC73855 C21H20O12 Myricitrin 464.1 -4.8524 2.45 -0.185 6 8 206.6 12 4 33 1
NPC98477 C14H20O8 (2S,3R,4S,5S,6R)-2-(3-hydroxy-5-methoxy-4-methylphenoxy)-6-(hydroxymethyl)oxane-3,4,5-triol 316.1158176 -2.0773 2.12 -0.57 5 5 128.84 4 2 22 0

Download Data

All data can be downloaded by:

   → Selecting data type in the below download table
   → Then click the download button.
Data Section
Select to Download
1. General Information & structure data (InChi, InChiKey, SMILES)  
2. Physico-chemical Properties