01
- Entity Type
- Ingredients
- Relation Groups
- 2
- Relation Preview
- 4
Basic Information
Grouped by core information, identifiers, and descriptions.
Core Information
- Name
- 2-oxobutanol
- Molecular Formula
- C4H8O2
- Molecular Weight
- No data
- Canonical SMILES
- CCC(=O)CO
- Isomeric SMILES
- CCC(=O)CO
- InChI
- InChI=1S/C4H8O2/c1-2-4(6)3-5/h5H,2-3H2,1H3
- Oral Bioavailability
- 63.803
- Drug Likeness
- 0.514
- 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 ingredient1 Herbs