01
- Entity Type
- Ingredients
- Relation Groups
- 2
- Relation Preview
- 9
Basic Information
Grouped by core information, identifiers, and descriptions.
Core Information
- Name
- Homovanillic acid
- Molecular Formula
- C9H10O4
- Molecular Weight
- No data
- Canonical SMILES
- COC1=C(C=CC(=C1)CC(=O)O)O
- Isomeric SMILES
- COC1=C(C=CC(=C1)CC(=O)O)O
- InChI
- InChI=1S/C9H10O4/c1-13-8-4-6(5-9(11)12)2-3-7(8)10/h2-4,10H,5H2,1H3,(H,11,12)
- Oral Bioavailability
- No data
- Drug Likeness
- 0.732
- 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