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: NPC59339
Formula: C35H64O8

Ingredient ID: NPC52968
Formula: C22H22O4

Ingredient ID: NPC327623
Formula: C26H33NO3

Ingredient ID: NPC323601
Formula: C22H24O4

Ingredient ID: NPC318575
Formula: C26H30O4

Ingredient ID: NPC31530
Formula: C22H24O7

Ingredient ID: NPC275150
Formula: C26H31NO3

Ingredient ID: NPC266001
Formula: C35H66O8

Ingredient ID: NPC261812
Formula: C23H28O7

Ingredient ID: NPC250530
Formula: C35H66O9

Ingredient ID: NPC246283
Formula: C35H64O8

Ingredient ID: NPC231719
Formula: C24H26O4

Ingredient ID: NPC230301
Formula: C29H50O

Ingredient ID: NPC213482
Formula: C24H30O9

Ingredient ID: NPC203719
Formula: C8H8O3

Ingredient ID: NPC20339
Formula: C35H64O8

Ingredient ID: NPC200244
Formula: C37H68O10

Ingredient ID: NPC183981
Formula: C35H64O7

Ingredient ID: NPC177868
Formula: C22H26O7

Ingredient ID: NPC172729
Formula: C35H64O8

Ingredient ID: NPC17090
Formula: C35H66O6

Ingredient ID: NPC139418
Formula: C37H66O9

Properties

Ingredient ID Formulae Name MW AlogP MlogP XlogP # HBA # HBD PSA # Rotatable Bond # Ring # Heacy Atom Lipinski RO5 Violation
NPC139418 C37H66O9 654.47 -8.3488 4.54 8.306 9 4 142.75 35 2 46 2
NPC17090 C35H66O6 582.4859398 -8.6591 4.65 10.337 6 4 107.22 29 1 41 2
NPC172729 C35H64O8 612.460119 -8.7279 4.43 7.566 8 5 136.68 26 2 43 2
NPC177868 C22H26O7 402.1678532 -0.9065 3.11 2.488 1 1 75.61 11 4 29 0
NPC183981 C35H64O7 596.4652044 -8.5052 4.54 9.651 7 4 116.45 26 2 42 2
NPC200244 C37H68O10 672.4812484 -9.1153 7.288 10 6 0 1 47 0
NPC20339 C35H64O8 612.46 -8.5607 4.43 8.272 8 5 136.68 33 2 43 2
NPC203719 C8H8O3 Vanillin 152.05 -0.7045 2.01 1.04 1 1 46.53 4 1 11 0
NPC213482 C24H30O9 462.1889825 -0.4114 3.11 2.1 3 0 98.75 20 2 33 1
NPC230301 C29H50O Beta-Sitosterol 414.39 1.3 4.54 11.595 1 1 20.23 13 4 30 1
NPC231719 C24H26O4 Tsangibeilin A 378.18 -0.7147 3.66 6.391 2 1 55.76 6 6 28 1
NPC246283 C35H64O8 612.460119 -8.7279 4.43 7.566 8 5 136.68 26 2 43 2
NPC250530 C35H66O9 630.4706837 -9.4944 6.548 9 7 0 1 44 0
NPC261812 C23H28O7 Rel-(7R,8R,7'r,8'r)-3',4'-Methylenedioxy-3,4,5,5'-Tetramethoxy-7,7'-Epoxylignan 416.18 -0.498 3.22 3.007 1 0 64.61 12 4 30 0
NPC266001 C35H66O8 614.4757691 -9.1045 7.433 8 6 0 1 43 0
NPC275150 C26H31NO3 Endiandramide A 405.23 0.095 3.88 6.539 2 1 51.05 8 6 30 1
NPC31530 C22H24O7 400.15 -0.6971 3.11 2.934 1 0 64.61 8 5 29 0
NPC318575 C26H30O4 406.21 -1.287 3.88 8.039 2 1 55.76 9 4 30 1
NPC323601 C22H24O4 352.17 -1.1825 3.44 5.663 2 1 55.76 6 4 26 1
NPC327623 C26H33NO3 407.25 -0.664 3.88 6.949 2 1 51.05 10 4 30 1
NPC52968 C22H22O4 Tsangibeilin B 350.15 -0.4235 3.44 5.253 2 1 55.76 4 6 26 1
NPC59339 C35H64O8 612.460119 -8.7279 4.43 7.988 8 5 136.68 26 2 43 2

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