29 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: NPC93335
Formula: C15H20O3

Ingredient ID: NPC90360
Formula: C30H40O6

Ingredient ID: NPC87982
Formula: C15H22O3

Ingredient ID: NPC50773
Formula: C30H38O6

Ingredient ID: NPC47274
Formula: C17H22O5

Ingredient ID: NPC34445
Formula: C17H22O5

Ingredient ID: NPC308382
Formula: C15H26O2

Ingredient ID: NPC308099
Formula: C17H24O7

Ingredient ID: NPC293567
Formula: C15H20O3

Ingredient ID: NPC282232
Formula: C17H24O7

Ingredient ID: NPC261004
Formula: C19H18O8

Ingredient ID: NPC247530
Formula: C21H20O7

Ingredient ID: NPC245333
Formula: C15H22O5

Ingredient ID: NPC243728
Formula: C35H60O6

Ingredient ID: NPC241244
Formula: C30H40O6

Ingredient ID: NPC230301
Formula: C29H50O

Ingredient ID: NPC224652
Formula: C15H18O3

Ingredient ID: NPC218378
Formula: C20H34O4

Ingredient ID: NPC189474
Formula: C22H24O7

Ingredient ID: NPC1786
Formula: C9H8O4

Ingredient ID: NPC176300
Formula: C20H20O8

Ingredient ID: NPC171928
Formula: C20H18O6

Ingredient ID: NPC151818
Formula: C15H20O3

Ingredient ID: NPC130690
Formula: C15H20O5

Ingredient ID: NPC113733
Formula: C29H48O

Ingredient ID: NPC113483
Formula: C22H26O8

Ingredient ID: NPC112813
Formula: C18H26O7

Ingredient ID: NPC106510
Formula: C15H18O5

Ingredient ID: NPC102404
Formula: C15H20O3

Properties

Ingredient ID Formulae Name MW AlogP MlogP XlogP # HBA # HBD PSA # Rotatable Bond # Ring # Heacy Atom Lipinski RO5 Violation
NPC102404 C15H20O3 248.1412445 1.012 2.78 1.191 3 1 46.53 0 3 18 0
NPC106510 C15H18O5 Isosecotanapartholide 278.12 0.0797 2.56 -0.563 5 1 80.67 7 2 20 0
NPC112813 C18H26O7 354.1678532 -0.5045 2.67 -0.258 7 2 102.29 3 3 25 0
NPC113483 C22H26O8 418.1627678 -2.2226 3 1.187 8 2 95.84 7 4 30 0
NPC113733 C29H48O Stigmasterol 412.37 1.2566 4.54 11.071 1 1 20.23 12 4 30 1
NPC130690 C15H20O5 280.1310737 -0.4054 2.56 -0.752 5 2 83.83 0 3 20 0
NPC151818 C15H20O3 248.1412445 0.5424 2.78 1.999 3 0 38.83 0 4 18 0
NPC171928 C20H18O6 Sesamin 354.11 -1.6034 3 2.576 2 0 55.38 2 6 26 0
NPC176300 C20H20O8 Artemetin 388.12 -1.563 2.78 1.957 2 1 92.68 12 3 28 0
NPC1786 C9H8O4 180.0422587 -0.7993 2.01 1.141 2 3 77.76 5 1 13 0
NPC189474 C22H24O7 400.15 -1.4561 3.11 2.205 2 0 64.61 8 5 29 0
NPC218378 C20H34O4 338.2457096 3.2028 3.22 4.783 4 0 52.6 13 0 24 1
NPC224652 C15H18O3 Ludartin 246.13 1.0791 2.78 1.221 3 0 38.83 2 4 18 0
NPC230301 C29H50O Beta-Sitosterol 414.39 1.3 4.54 11.595 1 1 20.23 13 4 30 1
NPC241244 C30H40O6 496.282489 1.0365 4.1 1.986 6 2 93.06 0 7 36 0
NPC243728 C35H60O6 Daucosterol 576.44 -0.4469 4.65 10.487 6 4 99.38 19 5 41 1
NPC245333 C15H22O5 282.1467238 -0.5258 2.56 -0.058 5 3 86.99 0 3 20 0
NPC247530 C21H20O7 384.120903 -1.6552 3 2.132 7 0 64.61 3 6 28 0
NPC261004 C19H18O8 Chrysosplenol B 374.1 -1.9715 2.67 1.438 2 2 103.68 11 3 27 0
NPC282232 C17H24O7 340.1522031 -0.8648 2.56 -1.091 7 3 113.29 2 3 24 0
NPC293567 C15H20O3 248.1412445 1.0163 2.78 1.652 3 0 38.83 0 4 18 0
NPC308099 C17H24O7 340.1522031 -0.913 2.56 -0.348 7 3 113.29 2 3 24 0
NPC308382 C15H26O2 238.1932801 3.5098 2.89 4.383 2 0 26.3 8 0 17 0
NPC34445 C17H22O5 306.1467238 0.6244 2.78 1.185 5 1 72.83 2 3 22 0
NPC47274 C17H22O5 306.1467238 0.6244 2.78 1.185 5 1 72.83 2 3 22 0
NPC50773 C30H38O6 494.2668389 0.6156 4.1 2.41 6 1 85.36 0 8 36 0
NPC87982 C15H22O3 250.1568946 1.7385 2.78 1.882 3 1 46.53 0 2 18 0
NPC90360 C30H40O6 496.282489 1.0565 4.1 2.149 6 2 93.06 0 7 36 0
NPC93335 C15H20O3 248.1412445 1.3647 2.78 1.287 3 1 46.53 0 3 18 0

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1. General Information & structure data (InChi, InChiKey, SMILES)  
2. Physico-chemical Properties