01
- Entity Type
- Ingredients
- Relation Groups
- 2
- Relation Preview
- 10
Basic Information
Grouped by core information, identifiers, and descriptions.
Core Information
- Name
- Khell
- Molecular Formula
- C14H12O5
- Molecular Weight
- No data
- Canonical SMILES
- CC1=CC(=O)C2=C(C3=C(C(=C2O1)OC)OC=C3)OC
- Isomeric SMILES
- CC1=CC(=O)C2=C(C3=C(C(=C2O1)OC)OC=C3)OC
- InChI
- InChI=1S/C14H12O5/c1-7-6-9(15)10-11(16-2)8-4-5-18-12(8)14(17-3)13(10)19-7/h4-6H,1-3H3
- Oral Bioavailability
- 33.193
- Drug Likeness
- 0.709
- 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 ingredient2 Herbs