01
- Entity Type
- Ingredients
- Relation Groups
- 2
- Relation Preview
- 9
Basic Information
Grouped by core information, identifiers, and descriptions.
Core Information
- Name
- Khellol
- Molecular Formula
- C13H10O5
- Molecular Weight
- No data
- Canonical SMILES
- COC1=C2C=COC2=CC3=C1C(=O)C=C(O3)CO
- Isomeric SMILES
- COC1=C2C=COC2=CC3=C1C(=O)C=C(O3)CO
- InChI
- InChI=1S/C13H10O5/c1-16-13-8-2-3-17-10(8)5-11-12(13)9(15)4-7(6-14)18-11/h2-5,14H,6H2,1H3
- Oral Bioavailability
- 68.361
- Drug Likeness
- 0.749
- 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