01
- Entity Type
- Ingredients
- Relation Groups
- 2
- Relation Preview
- 10
Basic Information
Grouped by core information, identifiers, and descriptions.
Core Information
- Name
- Octanoate
- Molecular Formula
- C8H15O2-
- Molecular Weight
- No data
- Canonical SMILES
- CCCCCCCC(=O)[O-]
- Isomeric SMILES
- CCCCCCCC(=O)[O-]
- InChI
- InChI=1S/C8H16O2/c1-2-3-4-5-6-7-8(9)10/h2-7H2,1H3,(H,9,10)/p-1
- Oral Bioavailability
- No data
- Drug Likeness
- 0.522
- 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