01
Ingredients
(2r)-6-(2-hydroxyethyl)-2,5,7-trimethyl-1-indanone
C14H18O2
- Entity Type
- Ingredients
- Relation Groups
- 2
- Relation Preview
- 10
Basic Information
Grouped by core information, identifiers, and descriptions.
Core Information
- Name
- (2r)-6-(2-hydroxyethyl)-2,5,7-trimethyl-1-indanone
- Molecular Formula
- C14H18O2
- Molecular Weight
- No data
- Canonical SMILES
- CC1CC2=C(C1=O)C(=C(C(=C2)C)CCO)C
- Isomeric SMILES
- C[C@@H]1CC2=C(C1=O)C(=C(C(=C2)C)CCO)C
- InChI
- InChI=1S/C14H18O2/c1-8-6-11-7-9(2)14(16)13(11)10(3)12(8)4-5-15/h6,9,15H,4-5,7H2,1-3H3/t9-/m1/s1
- Oral Bioavailability
- 46.599
- Drug Likeness
- 0.826
- 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