9 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: NPC70622
Formula: C15H10O5

Ingredient ID: NPC471683
Formula: C30H20O9

Ingredient ID: NPC471682
Formula: C30H20O8

Ingredient ID: NPC282923
Formula: C15H10O4

Ingredient ID: NPC239136
Formula: C30H18O8

Ingredient ID: NPC226656
Formula: C24H18O8

Ingredient ID: NPC19631
Formula: C30H18O8

Ingredient ID: NPC147250
Formula: C24H16O7

Ingredient ID: NPC119767
Formula: C22H14O7

Properties

Ingredient ID Formulae Name MW AlogP MlogP XlogP # HBA # HBD PSA # Rotatable Bond # Ring # Heacy Atom Lipinski RO5 Violation
NPC119767 C22H14O7 (4,5-Dihydroxy-9,10-Dioxoanthracen-2-Yl)Methyl 4-Hydroxybenzoate 390.07 -1.988 3.11 2.174 4 3 121.13 7 4 29 0
NPC147250 C24H16O7 (4,5-Dihydroxy-9,10-Dioxoanthracen-2-Yl)Methyl (E)-3-(4-Hydroxyphenyl)Prop-2-Enoate 416.09 -1.6269 3.33 2.99 4 3 121.13 8 4 31 0
NPC19631 C30H18O8 Microcarpin 506.1 -1.6124 3.88 2.422 4 4 149.2 7 6 38 0
NPC226656 C24H18O8 Knipholone 434.1 -2.0325 3.22 1.152 3 4 141.36 10 4 32 0
NPC239136 C30H18O8 Asphodeline 506.1 -1.6124 3.88 2.422 4 4 149.2 7 6 38 0
NPC282923 C15H10O4 Chrysophanol 254.06 -0.8062 2.67 1.627 2 2 74.6 3 3 19 0
NPC471682 C30H20O8 10-(Chrysophanol-7'-Yl)-10-Hydroxychrysophanol-9-Anthrone 508.12 -2.0938 3.88 2.404 4 5 152.36 8 6 38 0
NPC471683 C30H20O9 Chryslandicin 524.11 -2.5541 3.77 1.23 4 6 172.59 9 6 39 1
NPC70622 C15H10O5 Aloe-Emodin 270.05 -1.8969 2.56 0.284 3 3 94.83 4 3 20 0

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