01
- Entity Type
- Ingredients
- Relation Groups
- 5
- Relation Preview
- 34
Basic Information
Grouped by core information, identifiers, and descriptions.
Core Information
- Name
- Acetylshikonin
- Molecular Formula
- No data
- Molecular Weight
- 414.690
- Canonical SMILES
- c1([H])c(O[H])c(C(=O)C([H])=C([C@]([H])(OC(=O)C([H])([H])[H])C([H])([H])\C([H])=C(/C([H])([H])[H])\C([H])([H])[H])C2=O)c2c(O[H])c1[H]
- Isomeric SMILES
- No data
- InChI
- No data
- Oral Bioavailability
- 62.388
- 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
- 313275|5321359|6708616|160498
Description and Extensions
- Toxicity Information
- No data
Related
Related Entities
Direct relations and traceable candidates grouped by relation type.
Active Targets
ingredient target8 Targets