01
- Entity Type
- Ingredients
- Relation Groups
- 2
- Relation Preview
- 12
Basic Information
Grouped by core information, identifiers, and descriptions.
Core Information
- Name
- Nootkatin
- Molecular Formula
- C15H20O2
- Molecular Weight
- No data
- Canonical SMILES
- CC(C)C1=CC(=O)C(=CC=C1CC=C(C)C)O
- Isomeric SMILES
- CC(C)C1=CC(=O)C(=CC=C1CC=C(C)C)O
- InChI
- InChI=1S/C15H20O2/c1-10(2)5-6-12-7-8-14(16)15(17)9-13(12)11(3)4/h5,7-9,11H,6H2,1-4H3,(H,16,17)
- Oral Bioavailability
- 31.824
- Drug Likeness
- 0.811
- 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