01
- Entity Type
- Ingredients
- Relation Groups
- 2
- Relation Preview
- 8
Basic Information
Grouped by core information, identifiers, and descriptions.
Core Information
- Name
- 1,4-heptadiene
- Molecular Formula
- C7H12
- Molecular Weight
- No data
- Canonical SMILES
- CCC=CCC=C
- Isomeric SMILES
- CC/C=C/CC=C
- InChI
- InChI=1S/C7H12/c1-3-5-7-6-4-2/h3,6-7H,1,4-5H2,2H3/b7-6+
- Oral Bioavailability
- No data
- Drug Likeness
- 0.473
- 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.
Source Herbs
herb ingredient1 Herbs