11 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: NPC32373
Formula: C22H22O8

Ingredient ID: NPC237946
Formula: C22H22O8

Ingredient ID: NPC22130
Formula: C21H16O7

Ingredient ID: NPC174734
Formula: C22H18O8

Ingredient ID: NPC169037
Formula: C22H20O8

Ingredient ID: NPC157080
Formula: C15H18O7

Ingredient ID: NPC150943
Formula: C21H20O8

Ingredient ID: NPC14294
Formula: C27H30O13

Ingredient ID: NPC116775
Formula: C15H10O6

Ingredient ID: NPC115281
Formula: C22H22O8

Ingredient ID: NPC107909
Formula: C24H26O8

Properties

Ingredient ID Formulae Name MW AlogP MlogP XlogP # HBA # HBD PSA # Rotatable Bond # Ring # Heacy Atom Lipinski RO5 Violation
NPC107909 C24H26O8 (5R,5aR,8aS,9R)-5-ethoxy-9-(3,4,5-trimethoxyphenyl)-5a,6,8a,9-tetrahydro-5H-[2]benzofuro[5,6-f][1,3]benzodioxol-8-one 442.1627678 -0.8417 3.22 2.201 3 0 81.68 6 5 32 0
NPC115281 C22H22O8 Beta-Peltatin A 414.13 -1.129 3 1.326 2 1 92.68 8 5 30 0
NPC116775 C15H10O6 Kaempferol 286.05 -2.3409 2.45 1.915 2 4 107.22 5 3 21 0
NPC14294 C27H30O13 4-Demethyl-Podophyllotoxin-7'-O-Beta-D-Glucopyranoside 562.17 -3.656 3 -0.368 8 5 182.83 13 6 40 0
NPC150943 C21H20O8 4'-Demethylpodophyllotoxin 400.12 -1.9091 2.89 0.74 3 2 103.68 7 5 29 0
NPC157080 C15H18O7 310.1052529 -1.4726 2.34 -1.071 7 2 105.59 1 5 22 0
NPC169037 C22H20O8 (5aR,8aR,9R)-9-(3,4,5-trimethoxyphenyl)-5a,6,8a,9-tetrahydro-[2]benzofuro[5,6-f][1,3]benzodioxole-5,8-dione 412.1158176 -1.0923 3 1.212 3 0 89.52 4 5 30 0
NPC174734 C22H18O8 Dehydropodophyllotoxin 410.1 -0.9979 3 1.573 2 1 92.68 8 5 30 0
NPC22130 C21H16O7 Diphyllin 380.09 -0.9461 3 2.017 2 1 83.45 6 5 28 0
NPC237946 C22H22O8 Podofilox 414.13 -1.5006 3 1.259 3 1 92.68 8 5 30 0
NPC32373 C22H22O8 Picropodophyllotoxin 414.13 -1.5006 3 1.259 3 1 92.68 8 5 30 0

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