01
- Entity Type
- Ingredients
- Relation Groups
- 2
- Relation Preview
- 10
Basic Information
Grouped by core information, identifiers, and descriptions.
Core Information
- Name
- Stesakine
- Molecular Formula
- C19H19NO4
- Molecular Weight
- No data
- Canonical SMILES
- CN1CCC2=CC3=C(C4=C2C1CC5=C4C=CC(=C5OC)O)OCO3
- Isomeric SMILES
- CN1CCC2=CC3=C(C4=C2[C@H]1CC5=C4C=CC(=C5OC)O)OCO3
- InChI
- InChI=1S/C19H19NO4/c1-20-6-5-10-7-15-19(24-9-23-15)17-11-3-4-14(21)18(22-2)12(11)8-13(20)16(10)17/h3-4,7,13,21H,5-6,8-9H2,1-2H3/t13-/m1/s1
- Oral Bioavailability
- 23.760
- Drug Likeness
- 0.874
- 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