01
- Entity Type
- Ingredients
- Relation Groups
- 5
- Relation Preview
- 31
Basic Information
Grouped by core information, identifiers, and descriptions.
Core Information
- Name
- 3beta-Hydroxy-atractylon
- Molecular Formula
- No data
- Molecular Weight
- 236.290
- Canonical SMILES
- C1([H])([H])C([H])([H])[C@](C([H])([H])[H])(C([H])([H])c(oc([H])c2C([H])([H])[H])c2C3([H])[H])[C@]3([H])C(=C([H])[H])[C@]1([H])O[H]
- Isomeric SMILES
- No data
- InChI
- No data
- Oral Bioavailability
- 46.422
- Drug Likeness
- No data
- DL Score
- No data
- Caco-2 Permeability
- No data
- ALogP
- No data
- Bioavailability Score
- No data
Identifiers
- InChI Key
- No data
- PubChem CID
- 132759
Description and Extensions
- Toxicity Information
- No data
Related
Related Entities
Direct relations and traceable candidates grouped by relation type.