23 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.



11 Ingredients with Available Activity


Unique ingredients have activity data available.


Ingredient Structrual Cards

Ingredient ID: NPC84868
Formula: C32H52O2

Ingredient ID: NPC58654
Formula: C19H12O8

Ingredient ID: NPC50052
Formula: C32H50O4

Ingredient ID: NPC46912
Formula: C33H52O4

Ingredient ID: NPC31031
Formula: C32H52O4

Ingredient ID: NPC307063
Formula: C30H50O

Ingredient ID: NPC299856
Formula: C26H54O

Ingredient ID: NPC250543
Formula: C11H8O5

Ingredient ID: NPC244799
Formula: C12H12O5

Ingredient ID: NPC243728
Formula: C35H60O6

Ingredient ID: NPC230301
Formula: C29H50O

Ingredient ID: NPC225467
Formula: C30H48O

Ingredient ID: NPC215797
Formula: C47H84O2

Ingredient ID: NPC20791
Formula: C15H10O7

Ingredient ID: NPC178383
Formula: C30H50O2

Ingredient ID: NPC16943
Formula: C29H50O

Ingredient ID: NPC165967
Formula: C24H48O2

Ingredient ID: NPC142415
Formula: C30H48O3

Ingredient ID: NPC141765
Formula: C22H26O8

Ingredient ID: NPC120840
Formula: C32H50O4

Ingredient ID: NPC118695
Formula: C30H50O

Ingredient ID: NPC116775
Formula: C15H10O6

Ingredient ID: NPC102181
Formula: C21H20O10

Properties

Ingredient ID Formulae Name MW AlogP MlogP XlogP # HBA # HBD PSA # Rotatable Bond # Ring # Heacy Atom Lipinski RO5 Violation
NPC102181 C21H20O10 5,7-dihydroxy-2-(4-hydroxyphenyl)-3-[(2S,3S,4S,5S,6R)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxychromen-4-one 432.1056468 -3.9318 2.67 0.883 6 6 166.14 3 4 31 1
NPC116775 C15H10O6 Kaempferol 286.05 -2.3409 2.45 1.915 2 4 107.22 5 3 21 0
NPC118695 C30H50O 426.3861662 3.2175 4.65 12.613 1 0 17.07 0 5 31 1
NPC120840 C32H50O4 Acetyl Oleanolic Acid 498.37 2.5089 4.54 9.792 4 1 63.6 12 5 36 1
NPC141765 C22H26O8 Syringaresinol 418.16 -2.1258 3 0.796 2 2 95.84 12 4 30 0
NPC142415 C30H48O3 Oleanolic_Acid 456.36 2.1298 4.43 9.052 3 2 57.53 10 5 33 1
NPC165967 C24H48O2 tetracosanoic acid 368.3654308 -6.2017 3.88 12.122 2 1 37.3 22 0 26 2
NPC16943 C29H50O 414.3861662 1.3 4.54 11.595 1 1 20.23 6 4 30 1
NPC178383 C30H50O2 Betulin 442.38 2.1406 4.54 9.714 2 2 40.46 10 5 32 1
NPC20791 C15H10O7 Quercetin 302.04 -2.8012 2.34 1.381 2 5 127.45 6 3 22 0
NPC215797 C47H84O2 [(3S,8S,9S,10R,13R,14S,17R)-17-[(2R,5R)-5-ethyl-6-methylheptan-2-yl]-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl] octadecanoate 680.6471319 -2.5647 6.41 21.123 2 0 26.3 24 4 49 2
NPC225467 C30H48O 424.3705162 3.4176 4.65 12.495 1 0 17.07 8 5 31 1
NPC230301 C29H50O Beta-Sitosterol 414.39 1.3 4.54 11.595 1 1 20.23 13 4 30 1
NPC243728 C35H60O6 Daucosterol 576.44 -0.4469 4.65 10.487 6 4 99.38 19 5 41 1
NPC244799 C12H12O5 Fraxidin Methyl Ether 236.07 0.1146 2.23 1.163 1 0 53.99 6 2 17 0
NPC250543 C11H8O5 4-methoxy-[1,3]dioxolo[4,5-h]chromen-8-one 220.0371734 -0.0845 2.12 1.09 1 0 53.99 1 3 16 0
NPC299856 C26H54O hexacosan-1-ol 382.4174663 -7.3094 4.21 13.369 1 1 20.23 24 0 27 2
NPC307063 C30H50O Friedeline 426.39 3.2175 4.65 12.613 1 0 17.07 8 5 31 1
NPC31031 C32H52O4 500.3865601 2.7478 4.54 11.061 4 1 63.6 12 5 36 1
NPC46912 C33H52O4 3-Beta-Acetylolean-12-En-28-Methyl Ester 512.39 2.7599 4.65 10.113 4 0 52.6 13 5 37 1
NPC50052 C32H50O4 (4aS,6aR,6aS,6bR,8aR,10S,12aR,14bR)-10-acetyloxy-2,2,6a,6b,9,9,12a-heptamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylic acid 498.3709101 2.5089 4.54 9.792 4 1 63.6 3 5 36 1
NPC58654 C19H12O8 368.0532173 -1.2284 2.67 1.879 4 4 133.52 2 4 27 0
NPC84868 C32H52O2 468.3967309 2.9429 4.76 12.536 2 0 26.3 10 5 34 1

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