19 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.



5 Ingredients with Available Activity


Unique ingredients have activity data available.


Ingredient Structrual Cards

Ingredient ID: NPC54394
Formula: C16H12O7

Ingredient ID: NPC34236
Formula: C15H8O8

Ingredient ID: NPC31022
Formula: C15H10O13S2

Ingredient ID: NPC308314
Formula: C15H10O12S2

Ingredient ID: NPC300384
Formula: C14H6O8

Ingredient ID: NPC284062
Formula: C15H10O12S2

Ingredient ID: NPC241762
Formula: C14H10O10

Ingredient ID: NPC239198
Formula: C54H44O36

Ingredient ID: NPC237300
Formula: C40H30O26

Ingredient ID: NPC230001
Formula: C20H20O14

Ingredient ID: NPC226710
Formula: C15H8O11S

Ingredient ID: NPC225710
Formula: C7H6O5

Ingredient ID: NPC223167
Formula: C27H24O19

Ingredient ID: NPC21131
Formula: C16H12O13S2

Ingredient ID: NPC20791
Formula: C15H10O7

Ingredient ID: NPC155158
Formula: C15H8O14S2

Ingredient ID: NPC152851
Formula: C16H10O8

Ingredient ID: NPC139548
Formula: C10H8O4

Ingredient ID: NPC116775
Formula: C15H10O6

Properties

Ingredient ID Formulae Name MW AlogP MlogP XlogP # HBA # HBD PSA # Rotatable Bond # Ring # Heacy Atom Lipinski RO5 Violation
NPC116775 C15H10O6 Kaempferol 286.05 -2.3409 2.45 1.915 2 4 107.22 5 3 21 0
NPC139548 C10H8O4 Isoscopoletin 192.04 -0.2421 2.12 1.088 1 1 55.76 3 2 14 0
NPC152851 C16H10O8 330.0375673 -1.1296 2.34 1.294 8 2 111.52 2 4 24 0
NPC155158 C15H8O14S2 473.9198969 -2.7241 1.35 -2.55 8 1 231.68 5 4 31 0
NPC20791 C15H10O7 Quercetin 302.04 -2.8012 2.34 1.381 2 5 127.45 6 3 22 0
NPC21131 C16H12O13S2 [5-hydroxy-2-(3-hydroxy-4-methoxyphenyl)-4-oxo-3-sulfonatooxychromen-7-yl] sulfate 473.9562824 -3.5019 1.57 -2.101 8 2 225.61 6 3 31 0
NPC223167 C27H24O19 652.0911785 -5.8513 2.34 -1.158 10 12 330.89 10 4 46 1
NPC225710 C7H6O5 Gallic Acid 170.02 -1.6207 1.68 0.002 2 4 97.99 5 1 12 0
NPC226710 C15H8O11S 394.970907 -2.2647 1.79 -0.873 11 2 177.1 3 4 27 1
NPC230001 C20H20O14 484.0853053 -4.814 2.12 -1.681 8 9 251.74 11 2 34 2
NPC237300 C40H30O26 926.1025311 -7.9377 3 -0.348 10 16 447.34 8 7 66 1
NPC239198 C54H44O36 1268.161228 -10.4846 3.44 -1.23 18 20 599.32 8 9 90 2
NPC241762 C14H10O10 2-(5-carboxy-2,3-dihydroxyphenoxy)-3,4,5-trihydroxybenzoic acid 338.0273965 -2.9352 1.9 0.184 4 7 184.98 4 2 24 1
NPC284062 C15H10O12S2 443.9457177 -3.4501 1.57 -1.657 8 2 216.38 5 3 29 0
NPC300384 C14H6O8 302.0062672 -1.2586 2.12 0.652 8 4 133.52 0 4 22 0
NPC308314 C15H10O12S2 [5-hydroxy-2-(4-hydroxyphenyl)-4-oxo-3-sulfooxychromen-7-yl] hydrogen sulfate 445.9613678 -2.7825 1.57 -1.657 8 4 210.72 5 3 29 0
NPC31022 C15H10O13S2 459.9406323 -3.9104 1.46 -2.191 8 3 236.61 5 3 30 0
NPC34236 C15H8O8 316.0219172 -1.1941 2.23 0.973 8 3 122.52 1 4 23 0
NPC54394 C16H12O7 Tamarixetin 316.06 -2.3927 2.45 1.471 2 4 116.45 7 3 23 0

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