25 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.



5 Ingredients with Available Activity


Unique ingredients have activity data available.


Ingredient Structrual Cards

Ingredient ID: NPC89472
Formula: C25H22O5

Ingredient ID: NPC86545
Formula: C12H24O2

Ingredient ID: NPC6633
Formula: C18H14O5

Ingredient ID: NPC59551
Formula: C13H8O4

Ingredient ID: NPC59060
Formula: C24H24O4

Ingredient ID: NPC53344
Formula: C21H26N2O3

Ingredient ID: NPC475841
Formula: C21H26N2O3

Ingredient ID: NPC474145
Formula: C21H26N2O3

Ingredient ID: NPC40070
Formula: C20H19N3

Ingredient ID: NPC308115
Formula: C23H26O5

Ingredient ID: NPC302603
Formula: C30H50O3

Ingredient ID: NPC292419
Formula: C30H52O

Ingredient ID: NPC273548
Formula: C22H24O5

Ingredient ID: NPC264317
Formula: C30H48O3

Ingredient ID: NPC234987
Formula: C21H26N2O2

Ingredient ID: NPC218701
Formula: C18H16O5

Ingredient ID: NPC21025
Formula: C20H24N2O2

Ingredient ID: NPC200246
Formula: C18H14O6

Ingredient ID: NPC18457
Formula: C13H8O4

Ingredient ID: NPC184234
Formula: C14H10O5

Ingredient ID: NPC180777
Formula: C30H50O2

Ingredient ID: NPC158259
Formula: C24H24O5

Ingredient ID: NPC156342
Formula: C30H52

Ingredient ID: NPC113733
Formula: C29H48O

Ingredient ID: NPC113626
Formula: C20H24N2O2

Properties

Ingredient ID Formulae Name MW AlogP MlogP XlogP # HBA # HBD PSA # Rotatable Bond # Ring # Heacy Atom Lipinski RO5 Violation
NPC113626 C20H24N2O2 324.18 0.1982 3.22 2.949 4 1 45.47 5 4 24 0
NPC113733 C29H48O Stigmasterol 412.37 1.2566 4.54 11.071 1 1 20.23 12 4 30 1
NPC156342 C30H52 (4S,4aR,6aS,6aS,6bR,8aR,12aR,14aS,14bR)-4,4a,6a,6b,8a,11,11,14a-octamethyl-1,2,3,4,5,6,6a,7,8,9,10,12,12a,13,14,14b-hexadecahydropicene 412.4069017 3.2527 4.76 15.322 0 0 0 0 5 30 1
NPC158259 C24H24O5 5-hydroxy-8-methoxy-2,2-dimethyl-7-(3-methylbut-2-enyl)pyrano[3,2-b]xanthen-6-one 392.1623739 1.8552 3.55 4.003 1 1 64.99 3 4 29 0
NPC180777 C30H50O2 Canophyllol 442.38 2.1268 4.54 10.426 2 1 37.3 9 5 32 1
NPC184234 C14H10O5 1,6-dihydroxy-5-methoxyxanthen-9-one 258.0528234 -1.3903 2.45 1.133 1 2 75.99 1 3 19 0
NPC18457 C13H8O4 228.0422587 -1.3385 2.45 1.577 1 2 66.76 2 3 17 0
NPC200246 C18H14O6 Jacareubin 326.08 -0.891 2.78 1.48 1 3 96.22 5 4 24 0
NPC21025 C20H24N2O2 324.183778 0.1982 3.22 2.949 4 1 45.47 2 4 24 0
NPC218701 C18H16O5 1,3,5-trihydroxy-2-(3-methylbut-2-enyl)xanthen-9-one 312.0997736 0.0786 2.89 2.084 1 3 86.99 2 3 23 0
NPC234987 C21H26N2O2 338.1994281 0.6067 3.33 3.468 4 0 34.47 6 4 25 0
NPC264317 C30H48O3 Betulinic Acid 456.36 2.3495 4.43 9.407 3 2 57.53 10 5 33 1
NPC273548 C22H24O5 368.1623739 0.6857 3.33 3.458 2 0 61.83 2 4 27 0
NPC292419 C30H52O 428.4018163 2.4864 4.65 13.026 1 1 20.23 9 5 31 1
NPC302603 C30H50O3 458.3759955 2.0056 4.43 10.186 3 1 46.53 1 5 33 1
NPC308115 C23H26O5 382.1780239 1.8985 3.44 3.154 2 2 83.83 4 3 28 0
NPC40070 C20H19N3 301.1578976 0.4178 3.33 4.674 3 0 21.06 2 5 23 0
NPC474145 C21H26N2O3 354.19 0.3169 3.22 2.336 4 1 46.86 5 5 26 0
NPC475841 C21H26N2O3 354.19 0.3169 3.22 2.336 4 1 46.86 5 5 26 0
NPC53344 C21H26N2O3 354.19 0.1464 3.22 2.294 4 1 54.7 7 4 26 0
NPC59060 C24H24O4 376.1674592 0.8372 3.66 5.612 1 1 55.76 2 4 28 1
NPC59551 C13H8O4 1,5-Dihydroxyxanthen-9-One 228.04 -1.3385 2.45 1.577 1 2 66.76 2 3 17 0
NPC6633 C18H14O5 310.0841235 -0.4307 2.89 2.014 1 2 75.99 4 4 23 0
NPC86545 C12H24O2 200.17763 -2.3223 2.56 5.005 2 0 26.3 12 0 14 1
NPC89472 C25H22O5 402.1467238 0.86 3.66 5.593 2 0 61.83 1 5 30 1

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