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Ingredients

Cirsilneol

C18H16O6

Entity Type
Ingredients
Relation Groups
2
Relation Preview
14

Basic Information

Grouped by core information, identifiers, and descriptions.

Core Information

Name
Cirsilneol
Molecular Formula
C18H16O6
Molecular Weight
No data
Canonical SMILES
COC1=C(C=CC(=C1)C2=CC(=O)C3=CC(=C(C=C3O2)OC)OC)O
Isomeric SMILES
COC1=C(C=CC(=C1)C2=CC(=O)C3=CC(=C(C=C3O2)OC)OC)O
InChI
InChI=1S/C18H16O6/c1-21-16-6-10(4-5-12(16)19)14-8-13(20)11-7-17(22-2)18(23-3)9-15(11)24-14/h4-9,19H,1-3H3
Oral Bioavailability
81.958
Drug Likeness
0.792
DL Score
No data
Caco-2 Permeability
No data
ALogP
No data
Bioavailability Score
No data

Identifiers

InChI Key
No data
PubChem CID
No data

Description and Extensions

Toxicity Information
No data
Related

Direct relations and traceable candidates grouped by relation type.

Active Targets

ingredient target6 Targets
02
GABRA1
gamma-aminobutyric acid type A receptor subunit alpha1
gamma-aminobutyric acid type A receptor subunit alpha1
04
PTGS1
prostaglandin-endoperoxide synthase 1
prostaglandin-endoperoxide synthase 1
05
PTGS2
prostaglandin-endoperoxide synthase 2
prostaglandin-endoperoxide synthase 2