01
- Entity Type
- Ingredients
- Relation Groups
- 2
- Relation Preview
- 4
Basic Information
Grouped by core information, identifiers, and descriptions.
Core Information
- Name
- 1-(2,4,5-trimethoxyphenyl)-1,2-propanedione
- Molecular Formula
- C12H14O5
- Molecular Weight
- No data
- Canonical SMILES
- CC(=O)C(=O)C1=CC(=C(C=C1OC)OC)OC
- Isomeric SMILES
- CC(=O)C(=O)C1=CC(=C(C=C1OC)OC)OC
- InChI
- InChI=1S/C12H14O5/c1-7(13)12(14)8-5-10(16-3)11(17-4)6-9(8)15-2/h5-6H,1-4H3
- Oral Bioavailability
- No data
- Drug Likeness
- 0.574
- 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