01
- Entity Type
- Ingredients
- Relation Groups
- 2
- Relation Preview
- 10
Basic Information
Grouped by core information, identifiers, and descriptions.
Core Information
- Name
- Aloesone
- Molecular Formula
- C13H12O4
- Molecular Weight
- No data
- Canonical SMILES
- CC1=CC(=CC2=C1C(=O)C=C(O2)CC(=O)C)O
- Isomeric SMILES
- CC1=CC(=CC2=C1C(=O)C=C(O2)CC(=O)C)O
- InChI
- InChI=1S/C13H12O4/c1-7-3-9(15)5-12-13(7)11(16)6-10(17-12)4-8(2)14/h3,5-6,15H,4H2,1-2H3
- Oral Bioavailability
- 59.720
- Drug Likeness
- 0.859
- 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