01
- Entity Type
- Ingredients
- Relation Groups
- 2
- Relation Preview
- 6
Basic Information
Grouped by core information, identifiers, and descriptions.
Core Information
- Name
- Linalyl benzoate
- Molecular Formula
- C17H22O2
- Molecular Weight
- No data
- Canonical SMILES
- CC(=CCCC(C)(C=C)OC(=O)C1=CC=CC=C1)C
- Isomeric SMILES
- CC(=CCCC(C)(C=C)OC(=O)C1=CC=CC=C1)C
- InChI
- InChI=1S/C17H22O2/c1-5-17(4,13-9-10-14(2)3)19-16(18)15-11-7-6-8-12-15/h5-8,10-12H,1,9,13H2,2-4H3
- Oral Bioavailability
- No data
- Drug Likeness
- 0.553
- 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.