01
- Entity Type
- Ingredients
- Relation Groups
- 4
- Relation Preview
- 26
Basic Information
Grouped by core information, identifiers, and descriptions.
Core Information
- Name
- Strictosamide_qt
- Molecular Formula
- C20H20N2O3
- Molecular Weight
- No data
- Canonical SMILES
- C=CC1C2CC3C4=C(CCN3C(=O)C2=COC1O)C5=CC=CC=C5N4
- Isomeric SMILES
- C=C[C@@H]1[C@@H]2C[C@@H]3C4=C(CCN3C(=O)C2=CO[C@H]1O)C5=CC=CC=C5N4
- InChI
- InChI=1S/C20H20N2O3/c1-2-11-14-9-17-18-13(12-5-3-4-6-16(12)21-18)7-8-22(17)19(23)15(14)10-25-20(11)24/h2-6,10-11,14,17,20-21,24H,1,7-9H2/t11-,14+,17-,20-/m1/s1
- Oral Bioavailability
- 25.484
- Drug Likeness
- 0.787
- 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