01
- Entity Type
- Ingredients
- Relation Groups
- 2
- Relation Preview
- 9
Basic Information
Grouped by core information, identifiers, and descriptions.
Core Information
- Name
- (-)-isorotundene
- Molecular Formula
- C15H24
- Molecular Weight
- No data
- Canonical SMILES
- CC1CCC2C1CC3CCC2(CC3=C)C
- Isomeric SMILES
- C[C@@H]1CC[C@H]2[C@@H]1C[C@H]3CCC2(CC3=C)C
- InChI
- InChI=1S/C15H24/c1-10-4-5-14-13(10)8-12-6-7-15(14,3)9-11(12)2/h10,12-14H,2,4-9H2,1,3H3/t10-,12-,13-,14+,15?/m1/s1
- Oral Bioavailability
- 50.715
- Drug Likeness
- 0.513
- 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