01
- Entity Type
- Ingredients
- Relation Groups
- 2
- Relation Preview
- 16
Basic Information
Grouped by core information, identifiers, and descriptions.
Core Information
- Name
- Apiol
- Molecular Formula
- C12H14O4
- Molecular Weight
- No data
- Canonical SMILES
- COC1=C2C(=C(C(=C1)CC=C)OC)OCO2
- Isomeric SMILES
- COC1=C2C(=C(C(=C1)CC=C)OC)OCO2
- InChI
- InChI=1S/C12H14O4/c1-4-5-8-6-9(13-2)11-12(10(8)14-3)16-7-15-11/h4,6H,1,5,7H2,2-3H3
- Oral Bioavailability
- 16.818
- Drug Likeness
- 0.731
- 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.