13 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: NPC94045
Formula: C15H14O2

Ingredient ID: NPC78540
Formula: C15H10O4

Ingredient ID: NPC78539
Formula: C15H10O4

Ingredient ID: NPC62086
Formula: C10H16

Ingredient ID: NPC4152
Formula: C15H12O5

Ingredient ID: NPC27184
Formula: C10H18O

Ingredient ID: NPC243083
Formula: C15H12O4

Ingredient ID: NPC187432
Formula: C15H10O5

Ingredient ID: NPC183953
Formula: C16H12O6

Ingredient ID: NPC166894
Formula: C10H18O

Ingredient ID: NPC152042
Formula: C16H12O5

Ingredient ID: NPC127447
Formula: C16H12O4

Ingredient ID: NPC122828
Formula: C16H14O5

Properties

Ingredient ID Formulae Name MW AlogP MlogP XlogP # HBA # HBD PSA # Rotatable Bond # Ring # Heacy Atom Lipinski RO5 Violation
NPC122828 C16H14O5 (2R,3R)-Alpinone 286.08 -1.5978 2.67 2.677 2 2 75.99 5 3 21 0
NPC127447 C16H12O4 Techtochrysin 268.07 -1.0157 2.78 3.682 1 1 55.76 4 3 20 0
NPC152042 C16H12O5 Izalpinin 284.07 -1.4721 2.67 4.03 2 2 75.99 5 3 21 0
NPC166894 C10H18O 154.1357652 0.9432 2.45 2.734 1 1 20.23 4 2 11 0
NPC183953 C16H12O6 4-(5,7-dihydroxy-4-oxochromen-2-yl)-2-methoxyphenolate 299.0555631 -2.2701 2.56 1.123 1 2 99.05 2 3 22 0
NPC187432 C15H10O5 Galangin 270.05 -1.8806 2.56 3.511 2 3 86.99 4 3 20 0
NPC243083 C15H12O4 Pinocembrin 256.07 -1.3541 2.67 2.493 1 2 66.76 3 3 19 0
NPC27184 C10H18O 2-[(1R)-4-methylcyclohex-3-en-1-yl]propan-2-ol 154.1357652 1.1223 2.45 2.369 1 1 20.23 1 1 11 0
NPC4152 C15H12O5 272.0684735 -2.0063 2.56 2.158 2 3 86.99 4 3 20 0
NPC62086 C10H16 136.1252005 1.3695 2.56 4.222 0 0 0 2 1 10 0
NPC78539 C15H10O4 7-hydroxy-4-oxo-2-phenylchromen-5-olate 253.0500838 -1.758 2.67 3.163 1 1 69.59 1 3 19 0
NPC78540 C15H10O4 Chrysin 254.06 -1.4242 2.67 3.163 1 2 66.76 3 3 19 0
NPC94045 C15H14O2 Pinosylvin Methyl Ether 226.1 -0.0443 2.89 5.973 0 1 29.46 5 2 17 1

Download Data

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