01
- Entity Type
- Ingredients
- Relation Groups
- 2
- Relation Preview
- 2
Basic Information
Grouped by core information, identifiers, and descriptions.
Core Information
- Name
- Citrusinine i
- Molecular Formula
- C16H15NO5
- Molecular Weight
- No data
- Canonical SMILES
- CN1C2=C(C=CC=C2O)C(=O)C3=C1C(=C(C=C3O)OC)OC
- Isomeric SMILES
- CN1C2=C(C=CC=C2O)C(=O)C3=C1C(=C(C=C3O)OC)OC
- InChI
- InChI=1S/C16H15NO5/c1-17-13-8(5-4-6-9(13)18)15(20)12-10(19)7-11(21-2)16(22-3)14(12)17/h4-7,18-19H,1-3H3
- Oral Bioavailability
- No data
- Drug Likeness
- 0.709
- 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