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.



7 Ingredients with Available Activity


Unique ingredients have activity data available.


Ingredient Structrual Cards

Ingredient ID: NPC86469
Formula: C20H19NO5

Ingredient ID: NPC67978
Formula: C21H23NO5

Ingredient ID: NPC295439
Formula: C38H42N2O7

Ingredient ID: NPC251735
Formula: C37H40N2O6

Ingredient ID: NPC248109
Formula: C37H40N2O6

Ingredient ID: NPC200555
Formula: C20H19NO4.HI

Ingredient ID: NPC183485
Formula: C20H18NO4

Ingredient ID: NPC171409
Formula: C19H14NO4

Ingredient ID: NPC16452
Formula: C21H22NO4

Ingredient ID: NPC150006
Formula: C39H44N2O7

Ingredient ID: NPC13826
Formula: C20H19NO4

Ingredient ID: NPC121400
Formula: C20H21NO5

Ingredient ID: NPC10908
Formula: C38H42N2O6

Properties

Ingredient ID Formulae Name MW AlogP MlogP XlogP # HBA # HBD PSA # Rotatable Bond # Ring # Heacy Atom Lipinski RO5 Violation
NPC10908 C38H42N2O6 Isotetrandrine 622.3 0.274 4.76 6.098 2 0 61.86 10 6 46 1
NPC121400 C20H21NO5 355.1419728 -0.7769 3 1.694 2 1 66.02 4 4 26 0
NPC13826 C20H19NO4 Jatrorrhizine 338.14 -1.5606 3.11 1.039 2 1 49.2 6 4 25 0
NPC150006 C39H44N2O7 652.3148517 0.2222 4.76 5.654 2 0 71.09 5 6 48 1
NPC16452 C21H22NO4 Palmitine 352.15 -1.3839 3.22 2.969 0 0 40.8 8 4 26 0
NPC171409 C19H14NO4 Coptisine 320.09 -1.7821 3 2.823 0 0 40.8 0 6 24 0
NPC183485 C20H18NO4 336.1235831 -1.583 3.11 2.896 0 0 40.8 2 5 25 0
NPC200555 C20H19NO4.HI 337.1314081 -0.1035 3.11 1.92 3 0 48 6 4 25 0
NPC248109 C37H40N2O6 608.288637 -0.1345 4.65 5.79 2 1 72.86 3 7 45 1
NPC251735 C37H40N2O6 608.29 -0.1345 4.65 5.579 2 1 72.86 9 6 45 1
NPC295439 C38H42N2O7 638.2992017 -0.1863 4.65 5.135 2 1 82.09 4 6 47 1
NPC67978 C21H23NO5 Allocryptopine 369.16 -0.241 3.11 1.933 2 0 57.23 5 4 27 0
NPC86469 C20H19NO5 Protopine 353.13 -0.4401 3 1.86 2 0 57.23 1 5 26 0

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