01
- Entity Type
- Ingredients
- Relation Groups
- 2
- Relation Preview
- 2
Basic Information
Grouped by core information, identifiers, and descriptions.
Core Information
- Name
- 3-(3,4,5-trimethoxyphenyl)propanoic acid
- Molecular Formula
- C12H16O5
- Molecular Weight
- No data
- Canonical SMILES
- COC1=CC(=CC(=C1OC)OC)CCC(=O)O
- Isomeric SMILES
- COC1=CC(=CC(=C1OC)OC)CCC(=O)O
- InChI
- InChI=1S/C12H16O5/c1-15-9-6-8(4-5-11(13)14)7-10(16-2)12(9)17-3/h6-7H,4-5H2,1-3H3,(H,13,14)
- Oral Bioavailability
- No data
- Drug Likeness
- 0.820
- 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