01
- Entity Type
- Ingredients
- Relation Groups
- 2
- Relation Preview
- 6
Basic Information
Grouped by core information, identifiers, and descriptions.
Core Information
- Name
- (1s,4r)-2,3-dimethylbicyclo[2.2.1]hept-2-ene
- Molecular Formula
- C9H14
- Molecular Weight
- No data
- Canonical SMILES
- CC1=C(C2CCC1C2)C
- Isomeric SMILES
- CC1=C([C@H]2CC[C@@H]1C2)C
- InChI
- InChI=1S/C9H14/c1-6-7(2)9-4-3-8(6)5-9/h8-9H,3-5H2,1-2H3/t8-,9+
- Oral Bioavailability
- 43.091
- Drug Likeness
- 0.433
- 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 ingredient2 Herbs