01
- Entity Type
- Ingredients
- Relation Groups
- 2
- Relation Preview
- 5
Basic Information
Grouped by core information, identifiers, and descriptions.
Core Information
- Name
- 4-methylolfurfural
- Molecular Formula
- C6H6O3
- Molecular Weight
- No data
- Canonical SMILES
- C1=C(OC=C1CO)C=O
- Isomeric SMILES
- C1=C(OC=C1CO)C=O
- InChI
- InChI=1S/C6H6O3/c7-2-5-1-6(3-8)9-4-5/h1,3-4,7H,2H2
- Oral Bioavailability
- 70.888
- Drug Likeness
- 0.590
- 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 ingredient3 Herbs