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Herb Integrative Database
Traditional Medicine Data Platform
Ingredients

Trans-nepetalactone

C10H14O2

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Entity Type
Ingredients
Relation Groups
2
Relation Preview
8

Basic Information

Grouped by core information, identifiers, and descriptions.

Core Information

Name
Trans-nepetalactone
Molecular Formula
C10H14O2
Molecular Weight
No data
Canonical SMILES
CC1CCC2C1C(=O)OC=C2C
Isomeric SMILES
CC1CCC2C1C(=O)OC=C2C
InChI
InChI=1S/C10H14O2/c1-6-3-4-8-7(2)5-12-10(11)9(6)8/h5-6,8-9H,3-4H2,1-2H3
Oral Bioavailability
70.005
Drug Likeness
0.515
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 target6 Targets
GraphMore Targets
01
ACHE
acetylcholinesterase (Cartwright blood group)
acetylcholinesterase (Cartwright blood group)
DetailsGraph
02
CHRM1
cholinergic receptor muscarinic 1
cholinergic receptor muscarinic 1
DetailsGraph
03
CHRM3
cholinergic receptor muscarinic 3
cholinergic receptor muscarinic 3
DetailsGraph
05
GABRA1
gamma-aminobutyric acid type A receptor subunit alpha1
gamma-aminobutyric acid type A receptor subunit alpha1
DetailsGraph