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Herb Integrative Database
Traditional Medicine Data Platform
Ingredients

Zederone

C15H18O3

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Entity Type
Ingredients
Relation Groups
2
Relation Preview
15

Basic Information

Grouped by core information, identifiers, and descriptions.

Core Information

Name
Zederone
Molecular Formula
C15H18O3
Molecular Weight
No data
Canonical SMILES
CC1=CCCC2(C(O2)C(=O)C3=C(C1)OC=C3C)C
Isomeric SMILES
C/C/1=C/CC[C@@]2([C@@H](O2)C(=O)C3=C(C1)OC=C3C)C
InChI
InChI=1S/C15H18O3/c1-9-5-4-6-15(3)14(18-15)13(16)12-10(2)8-17-11(12)7-9/h5,8,14H,4,6-7H2,1-3H3/b9-5-/t14-,15+/m0/s1
Oral Bioavailability
40.598
Drug Likeness
0.521
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

Related Entities

Direct relations and traceable candidates grouped by relation type.

Source HerbsActive Targets

Active Targets

ingredient target7 Targets
GraphMore Targets
02
CHRM1
cholinergic receptor muscarinic 1
cholinergic receptor muscarinic 1
DetailsGraph
03
CHRM3
cholinergic receptor muscarinic 3
cholinergic receptor muscarinic 3
DetailsGraph
04
CHRNA7
cholinergic receptor nicotinic alpha 7 subunit
cholinergic receptor nicotinic alpha 7 subunit
DetailsGraph
06
GABRA1
gamma-aminobutyric acid type A receptor subunit alpha1
gamma-aminobutyric acid type A receptor subunit alpha1
DetailsGraph