01
- Entity Type
- Ingredients
- Relation Groups
- 2
- Relation Preview
- 9
Basic Information
Grouped by core information, identifiers, and descriptions.
Core Information
- Name
- Violanone
- Molecular Formula
- C17H16O6
- Molecular Weight
- No data
- Canonical SMILES
- COC1=C(C(=C(C=C1)C2COC3=C(C2=O)C=CC(=C3)O)OC)O
- Isomeric SMILES
- COC1=C(C(=C(C=C1)C2COC3=C(C2=O)C=CC(=C3)O)OC)O
- InChI
- InChI=1S/C17H16O6/c1-21-13-6-5-10(17(22-2)16(13)20)12-8-23-14-7-9(18)3-4-11(14)15(12)19/h3-7,12,18,20H,8H2,1-2H3
- Oral Bioavailability
- 80.236
- Drug Likeness
- 0.905
- 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.
Active Targets
ingredient target8 Targets
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