01
Ingredients
(5alpha,8alpha)-2-oxo-1(10),3,7(11)-guaiatrien-12,8-olide
C15H16O3
- Entity Type
- Ingredients
- Relation Groups
- 2
- Relation Preview
- 3
Basic Information
Grouped by core information, identifiers, and descriptions.
Core Information
- Name
- (5alpha,8alpha)-2-oxo-1(10),3,7(11)-guaiatrien-12,8-olide
- Molecular Formula
- C15H16O3
- Molecular Weight
- No data
- Canonical SMILES
- CC1=C2C(CC3=C(C(=O)OC3C1)C)C(=CC2=O)C
- Isomeric SMILES
- CC1=C2[C@@H](CC3=C(C(=O)O[C@H]3C1)C)C(=CC2=O)C
- InChI
- InChI=1S/C15H16O3/c1-7-4-12(16)14-8(2)5-13-11(6-10(7)14)9(3)15(17)18-13/h4,10,13H,5-6H2,1-3H3/t10-,13-/m0/s1
- Oral Bioavailability
- No data
- Drug Likeness
- 0.615
- 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 target2 Targets