01
- Entity Type
- Ingredients
- Relation Groups
- 2
- Relation Preview
- 14
Basic Information
Grouped by core information, identifiers, and descriptions.
Core Information
- Name
- Zizyphusine
- Molecular Formula
- C20H24NO4+
- Molecular Weight
- No data
- Canonical SMILES
- C[N+]1(CCC2=CC(=C(C3=C2C1CC4=C3C(=C(C=C4)OC)OC)O)O)C
- Isomeric SMILES
- C[N+]1(CCC2=CC(=C(C3=C2[C@@H]1CC4=C3C(=C(C=C4)OC)OC)O)O)C
- InChI
- InChI=1S/C20H23NO4/c1-21(2)8-7-12-10-14(22)19(23)18-16(12)13(21)9-11-5-6-15(24-3)20(25-4)17(11)18/h5-6,10,13H,7-9H2,1-4H3,(H-,22,23)/p+1/t13-/m0/s1
- Oral Bioavailability
- 41.527
- Drug Likeness
- 0.651
- 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.