14 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: NPC76691
Formula: C17H30O3

Ingredient ID: NPC68779
Formula: C20H22O6

Ingredient ID: NPC306589
Formula: C17H18O5

Ingredient ID: NPC298192
Formula: C21H24O5

Ingredient ID: NPC26960
Formula: C20H40O

Ingredient ID: NPC264779
Formula: C15H26O

Ingredient ID: NPC25666
Formula: C21H26O5

Ingredient ID: NPC240722
Formula: C11H10O4

Ingredient ID: NPC235135
Formula: C23H28O5

Ingredient ID: NPC229517
Formula: C13H16O4

Ingredient ID: NPC218311
Formula: C13H18O5

Ingredient ID: NPC195749
Formula: C18H19NO4

Ingredient ID: NPC111888
Formula: C8H8O4

Ingredient ID: NPC101670
Formula: C11H14O5

Properties

Ingredient ID Formulae Name MW AlogP MlogP XlogP # HBA # HBD PSA # Rotatable Bond # Ring # Heacy Atom Lipinski RO5 Violation
NPC101670 C11H14O5 4-Hydroxy-3,5-Dimethoxy-4-(2-Oxopropyl)Cyclohexa-2,5-Dien-1-One 226.08 -1.5031 2.12 -0.219 5 1 72.83 8 1 16 0
NPC111888 C8H8O4 Vanillic Acid 168.04 -0.7519 1.9 0.626 2 2 66.76 5 1 12 0
NPC195749 C18H19NO4 N-Trans-Feruloyl Tyramine 313.13 -0.6499 2.89 3.109 2 3 82.28 10 2 23 0
NPC218311 C13H18O5 254.1154237 -1.2665 2.34 -0.647 5 3 86.99 2 2 18 0
NPC229517 C13H16O4 236.104859 -0.1554 2.45 0.588 4 2 66.76 1 2 17 0
NPC235135 C23H28O5 384.193674 -1.1994 3.44 3.853 5 0 69.67 8 3 28 0
NPC240722 C11H10O4 Scoparone 206.06 0.1664 2.23 1.607 1 0 44.76 4 2 15 0
NPC25666 C21H26O5 Monascin 358.18 -0.5092 3.22 2.381 5 0 69.67 9 3 26 0
NPC264779 C15H26O Beta-Eudesmol 222.2 0.6981 3 4.83 1 1 20.23 5 2 16 0
NPC26960 C20H40O Trans-Phytol 296.31 1.7816 3.55 8.949 1 1 20.23 19 0 21 2
NPC298192 C21H24O5 356.1623739 -0.6234 3.22 2.715 5 0 69.67 6 3 26 0
NPC306589 C17H18O5 302.1154237 0.2786 2.78 0.421 5 0 69.67 2 3 22 0
NPC68779 C20H22O6 Matairesinol 358.14 -0.9121 3 2.415 2 2 85.22 10 3 26 0
NPC76691 C17H30O3 282.2194948 -3.0828 3 4.823 3 1 46.53 11 1 20 1

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