01
- Entity Type
- Ingredients
- Relation Groups
- 2
- Relation Preview
- 12
Basic Information
Grouped by core information, identifiers, and descriptions.
Core Information
- Name
- Sanshool
- Molecular Formula
- C16H25NO
- Molecular Weight
- No data
- Canonical SMILES
- CC=CC=CC=CCCC=CC(=O)NCC(C)C
- Isomeric SMILES
- C/C=C/C=C/C=C\CC/C=C/C(=O)NCC(C)C
- InChI
- InChI=1S/C16H25NO/c1-4-5-6-7-8-9-10-11-12-13-16(18)17-14-15(2)3/h4-9,12-13,15H,10-11,14H2,1-3H3,(H,17,18)/b5-4+,7-6+,9-8-,13-12+
- Oral Bioavailability
- 53.410
- Drug Likeness
- 0.395
- 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.