01
- Entity Type
- Ingredients
- Relation Groups
- 2
- Relation Preview
- 9
Basic Information
Grouped by core information, identifiers, and descriptions.
Core Information
- Name
- Anisylacetone
- Molecular Formula
- C11H14O2
- Molecular Weight
- No data
- Canonical SMILES
- CC(=O)CCC1=CC=C(C=C1)OC
- Isomeric SMILES
- CC(=O)CCC1=CC=C(C=C1)OC
- InChI
- InChI=1S/C11H14O2/c1-9(12)3-4-10-5-7-11(13-2)8-6-10/h5-8H,3-4H2,1-2H3
- Oral Bioavailability
- No data
- Drug Likeness
- 0.706
- 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 ingredient8 Herbs