01
Ingredients
(6s)-2-methyl-6-[(1r)-4-methyl-1-cyclohexa-2,4-dienyl]hept-2-en-4-one
C15H22O
- Entity Type
- Ingredients
- Relation Groups
- 2
- Relation Preview
- 7
Basic Information
Grouped by core information, identifiers, and descriptions.
Core Information
- Name
- (6s)-2-methyl-6-[(1r)-4-methyl-1-cyclohexa-2,4-dienyl]hept-2-en-4-one
- Molecular Formula
- C15H22O
- Molecular Weight
- No data
- Canonical SMILES
- CC1=CCC(C=C1)C(C)CC(=O)C=C(C)C
- Isomeric SMILES
- CC1=CC[C@@H](C=C1)[C@@H](C)CC(=O)C=C(C)C
- InChI
- InChI=1S/C15H22O/c1-11(2)9-15(16)10-13(4)14-7-5-12(3)6-8-14/h5-7,9,13-14H,8,10H2,1-4H3/t13-,14+/m0/s1
- Oral Bioavailability
- 47.543
- Drug Likeness
- 0.650
- 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 target6 Targets
02
03
GABRA1
gamma-aminobutyric acid type A receptor subunit alpha1
gamma-aminobutyric acid type A receptor subunit alpha1
04
05
06