01
- Entity Type
- Ingredients
- Relation Groups
- 2
- Relation Preview
- 7
Basic Information
Grouped by core information, identifiers, and descriptions.
Core Information
- Name
- Alpha-sinensal
- Molecular Formula
- C15H22O
- Molecular Weight
- No data
- Canonical SMILES
- CC(=CCC=C(C)C=C)CCC=C(C)C=O
- Isomeric SMILES
- C/C(=C\C/C=C(\C)/C=C)/CC/C=C(\C)/C=O
- InChI
- InChI=1S/C15H22O/c1-5-13(2)8-6-9-14(3)10-7-11-15(4)12-16/h5,8-9,11-12H,1,6-7,10H2,2-4H3/b13-8+,14-9+,15-11+
- Oral Bioavailability
- 57.792
- Drug Likeness
- 0.268
- 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.