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.



9 Ingredients with Available Activity


Unique ingredients have activity data available.


Ingredient Structrual Cards

Ingredient ID: NPC82979
Formula: C20H30O3

Ingredient ID: NPC78326
Formula: C18H16O7

Ingredient ID: NPC64419
Formula: C20H32O3

Ingredient ID: NPC51781
Formula: C20H32O3

Ingredient ID: NPC48945
Formula: C20H32O3

Ingredient ID: NPC40552
Formula: C31H50O3

Ingredient ID: NPC311100
Formula: C22H34O4

Ingredient ID: NPC307335
Formula: C31H50O4

Ingredient ID: NPC282169
Formula: C21H18O11

Ingredient ID: NPC264317
Formula: C30H48O3

Ingredient ID: NPC263049
Formula: C20H32O3

Ingredient ID: NPC25864
Formula: C20H34O3

Ingredient ID: NPC252604
Formula: C22H34O4

Ingredient ID: NPC246882
Formula: C31H50O4

Ingredient ID: NPC245773
Formula: C25H50O2

Ingredient ID: NPC230301
Formula: C29H50O

Ingredient ID: NPC220189
Formula: C20H32O3

Ingredient ID: NPC177003
Formula: C20H32O3

Ingredient ID: NPC173888
Formula: C22H34O4

Ingredient ID: NPC168999
Formula: C22H34O4

Ingredient ID: NPC159362
Formula: C29H50O

Ingredient ID: NPC146679
Formula: C17H14O6

Ingredient ID: NPC136313
Formula: C31H50O4

Ingredient ID: NPC11107
Formula: C23H36O3

Properties

Ingredient ID Formulae Name MW AlogP MlogP XlogP # HBA # HBD PSA # Rotatable Bond # Ring # Heacy Atom Lipinski RO5 Violation
NPC11107 C23H36O3 360.266445 1.0948 3.66 5.253 3 0 35.53 0 5 26 1
NPC136313 C31H50O4 Maslinic Acid Methyl Ester 486.37 2.1581 4.43 8.561 4 2 66.76 12 5 35 1
NPC146679 C17H14O6 Kumatakenin 314.08 -1.8679 2.67 2.326 2 2 85.22 7 3 23 0
NPC159362 C29H50O (3S,8R,9R,10R,13R,14R,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-ol 414.3861662 1.3 4.54 11.595 1 1 20.23 6 4 30 1
NPC168999 C22H34O4 362.2457096 0.7389 3.44 4.151 4 1 63.6 3 4 26 0
NPC173888 C22H34O4 362.2457096 -0.0117 3.44 5.189 4 1 63.6 3 4 26 1
NPC177003 C20H32O3 320.2351449 -0.3908 3.33 4.449 3 2 57.53 1 4 23 0
NPC220189 C20H32O3 320.2351449 0.3598 3.33 3.411 3 2 57.53 1 4 23 0
NPC230301 C29H50O Beta-Sitosterol 414.39 1.3 4.54 11.595 1 1 20.23 13 4 30 1
NPC245773 C25H50O2 ethyl tricosanoate 382.3810808 -5.4123 3.99 12.297 2 0 26.3 23 0 27 2
NPC246882 C31H50O4 486.3709101 1.5121 4.43 8.463 4 2 66.76 2 5 35 1
NPC252604 C22H34O4 362.2457096 0.7389 3.44 4.151 4 1 63.6 3 4 26 0
NPC25864 C20H34O3 322.2507949 -0.2099 3.33 4.018 3 3 60.69 1 4 23 0
NPC263049 C20H32O3 320.2351449 0.3598 3.33 3.411 3 2 57.53 1 4 23 0
NPC264317 C30H48O3 Betulinic Acid 456.36 2.3495 4.43 9.407 3 2 57.53 10 5 33 1
NPC282169 C21H18O11 Apigenin-7-O-Beta-D-Glucuronide 446.08 -3.5292 2.56 0.616 7 6 183.21 10 4 32 1
NPC307335 C31H50O4 Corosolic Acid Methyl Ester 486.37 1.5121 4.43 8.463 4 2 66.76 12 5 35 1
NPC311100 C22H34O4 362.2457096 0.7389 3.44 4.151 4 1 63.6 3 4 26 0
NPC40552 C31H50O3 Methyl Ursolate 470.38 1.7348 4.54 9.275 3 1 46.53 11 5 34 1
NPC48945 C20H32O3 320.2351449 0.3598 3.33 3.411 3 2 57.53 1 4 23 0
NPC51781 C20H32O3 320.2351449 0.3598 3.33 3.411 3 2 57.53 1 4 23 0
NPC64419 C20H32O3 320.2351449 0.3598 3.33 3.411 3 2 57.53 1 4 23 0
NPC78326 C18H16O7 Pachypodol 344.09 -1.9197 2.67 1.882 2 2 94.45 9 3 25 0
NPC82979 C20H30O3 318.22 1.0012 3.33 3.864 3 2 57.53 7 3 23 0

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