18 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.



7 Ingredients with Available Activity


Unique ingredients have activity data available.


Ingredient Structrual Cards

Ingredient ID: NPC85276
Formula: C9H13NO2

Ingredient ID: NPC60278
Formula: C20H30N2O4

Ingredient ID: NPC46801
Formula: C40H56O4

Ingredient ID: NPC46159
Formula: C15H26N2

Ingredient ID: NPC38065
Formula: C15H10O6

Ingredient ID: NPC302248
Formula: C15H24N2O

Ingredient ID: NPC294185
Formula: C40H60

Ingredient ID: NPC271803
Formula: C15H24N2O

Ingredient ID: NPC254702
Formula: C16H12O6

Ingredient ID: NPC243635
Formula: C15H26N2

Ingredient ID: NPC239572
Formula: C19H24O6

Ingredient ID: NPC197313
Formula: C15H24N2O2

Ingredient ID: NPC194653
Formula: C16H12O6

Ingredient ID: NPC179950
Formula: C21H20O12

Ingredient ID: NPC151004
Formula: C15H26N2

Ingredient ID: NPC139134
Formula: C15H24N2O

Ingredient ID: NPC125732
Formula: C8H11NO

Ingredient ID: NPC118009
Formula: C15H24N2O3

Properties

Ingredient ID Formulae Name MW AlogP MlogP XlogP # HBA # HBD PSA # Rotatable Bond # Ring # Heacy Atom Lipinski RO5 Violation
NPC118009 C15H24N2O3 280.1786926 -3.5175 2.56 0.016 5 2 64.01 0 4 20 0
NPC125732 C8H11NO Tyramine 137.08 -0.943 2.12 1.104 1 2 46.25 4 1 10 0
NPC139134 C15H24N2O 248.1888634 -2.804 2.78 1.377 3 0 23.55 0 4 18 0
NPC151004 C15H26N2 234.21 -2.3058 2.89 2.12 2 0 6.48 0 4 17 0
NPC179950 C21H20O12 Isoquercetin 464.1 -4.8921 2.45 -0.354 7 8 206.6 12 4 33 1
NPC194653 C16H12O6 300.0633881 -2.0994 2.56 1.068 1 3 96.22 6 3 22 0
NPC197313 C15H24N2O2 264.183778 -2.8653 2.67 0.351 4 1 43.78 0 4 19 0
NPC239572 C19H24O6 348.1572885 -0.8383 2.89 0.457 6 3 104.06 1 5 25 0
NPC243635 C15H26N2 Sparteine 234.21 -2.3058 2.89 2.12 2 0 6.48 0 4 17 0
NPC254702 C16H12O6 300.0633881 -2.0994 2.56 1.068 1 3 96.22 6 3 22 0
NPC271803 C15H24N2O Lupanine 248.19 -2.6426 2.78 1.381 3 0 23.55 0 4 18 0
NPC294185 C40H60 (6E,10E,12E,14E,16E,18E,20E,22E,26E)-2,6,10,14,19,23,27,31-octamethyldotriaconta-2,6,10,12,14,16,18,20,22,26,30-undecaene 540.4695019 11.273 5.86 14.67 0 0 0 18 0 40 2
NPC302248 C15H24N2O 248.1888634 -2.6426 2.78 1.381 3 0 23.55 0 4 18 0
NPC38065 C15H10O6 Orobol 286.05 -2.5079 2.45 0.978 1 4 107.22 5 3 21 0
NPC46159 C15H26N2 234.2095988 -2.3058 2.89 2.12 2 0 6.48 0 4 17 0
NPC46801 C40H56O4 (1R,3S)-6-[(3E,5E,7E,9E,11E,13E,15E,17E)-18-[(1R,3S,6S)-3-hydroxy-1,5,5-trimethyl-7-oxabicyclo[4.1.0]heptan-6-yl]-3,7,12,16-tetramethyloctadeca-1,3,5,7,9,11,13,15,17-nonaenylidene]-1,5,5-trimethylcyclohexane-1,3-diol 600.4178603 6.9483 5.42 10.319 4 3 73.22 9 3 44 1
NPC60278 C20H30N2O4 362.2205574 -1.7946 3 1.753 6 1 70.08 3 4 26 0
NPC85276 C9H13NO2 Deoxiepinephrine 167.09 -0.9715 2.12 0.96 1 3 52.49 6 1 12 0

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