01
- 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 Herbs
herb ingredient2 Herbs