01
Ingredients
(9as)-2,5,9,9-tetramethyl-3,4,6,7,8,9a-hexahydrobenzo[7]annulene
C15H24
- Entity Type
- Ingredients
- Relation Groups
- 2
- Relation Preview
- 9
Basic Information
Grouped by core information, identifiers, and descriptions.
Core Information
- Name
- (9as)-2,5,9,9-tetramethyl-3,4,6,7,8,9a-hexahydrobenzo[7]annulene
- Molecular Formula
- C15H24
- Molecular Weight
- No data
- Canonical SMILES
- CC1=CC2C(=C(CCCC2(C)C)C)CC1
- Isomeric SMILES
- CC1=C[C@@H]2C(=C(CCCC2(C)C)C)CC1
- InChI
- InChI=1S/C15H24/c1-11-7-8-13-12(2)6-5-9-15(3,4)14(13)10-11/h10,14H,5-9H2,1-4H3/t14-/m1/s1
- Oral Bioavailability
- 45.360
- Drug Likeness
- 0.494
- 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