01
- Entity Type
- Ingredients
- Relation Groups
- 2
- Relation Preview
- 5
Basic Information
Grouped by core information, identifiers, and descriptions.
Core Information
- Name
- Irisoquin a
- Molecular Formula
- C23H38O4
- Molecular Weight
- No data
- Canonical SMILES
- CCCCCCCCCCCCCCCCC1=C(C(=O)C=C(C1=O)OC)O
- Isomeric SMILES
- CCCCCCCCCCCCCCCCC1=C(C(=O)C=C(C1=O)OC)O
- InChI
- InChI=1S/C23H38O4/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-19-22(25)20(24)18-21(27-2)23(19)26/h18,25H,3-17H2,1-2H3
- Oral Bioavailability
- No data
- Drug Likeness
- 0.251
- 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 ingredient1 Herbs