01
Ingredients
(3ar,4r,6z,10z,11ar)-4-hydroxy-6,10-dimethyl-3-methylene-3a,4,5,8,9,11a-hexahydrocyclodeca[d]furan-2-one
C15H20O3
- Entity Type
- Ingredients
- Relation Groups
- 2
- Relation Preview
- 9
Basic Information
Grouped by core information, identifiers, and descriptions.
Core Information
- Name
- (3ar,4r,6z,10z,11ar)-4-hydroxy-6,10-dimethyl-3-methylene-3a,4,5,8,9,11a-hexahydrocyclodeca[d]furan-2-one
- Molecular Formula
- C15H20O3
- Molecular Weight
- No data
- Canonical SMILES
- CC1=CC2C(C(CC(=CCC1)C)O)C(=C)C(=O)O2
- Isomeric SMILES
- C/C/1=C/[C@@H]2[C@@H]([C@@H](C/C(=C\CC1)/C)O)C(=C)C(=O)O2
- InChI
- InChI=1S/C15H20O3/c1-9-5-4-6-10(2)8-13-14(12(16)7-9)11(3)15(17)18-13/h5,8,12-14,16H,3-4,6-7H2,1-2H3/b9-5-,10-8-/t12-,13-,14-/m1/s1
- Oral Bioavailability
- 52.453
- Drug Likeness
- 0.407
- 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.