01
- Entity Type
- Ingredients
- Relation Groups
- 2
- Relation Preview
- 6
Basic Information
Grouped by core information, identifiers, and descriptions.
Core Information
- Name
- Vulgarole
- Molecular Formula
- C12H20O3
- Molecular Weight
- No data
- Canonical SMILES
- CC(=O)OC1C(C2CCC1(C2(C)C)C)O
- Isomeric SMILES
- CC(=O)OC1C(C2CCC1(C2(C)C)C)O
- InChI
- InChI=1S/C12H20O3/c1-7(13)15-10-9(14)8-5-6-12(10,4)11(8,2)3/h8-10,14H,5-6H2,1-4H3
- Oral Bioavailability
- 49.040
- Drug Likeness
- 0.673
- 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