01
- Entity Type
- Ingredients
- Relation Groups
- 2
- Relation Preview
- 12
Basic Information
Grouped by core information, identifiers, and descriptions.
Core Information
- Name
- Preskimmianine
- Molecular Formula
- C17H21NO4
- Molecular Weight
- No data
- Canonical SMILES
- CC(=CCC1=C(C2=C(C(=C(C=C2)OC)OC)NC1=O)OC)C
- Isomeric SMILES
- CC(=CCC1=C(C2=C(C(=C(C=C2)OC)OC)NC1=O)OC)C
- InChI
- InChI=1S/C17H21NO4/c1-10(2)6-7-12-15(21-4)11-8-9-13(20-3)16(22-5)14(11)18-17(12)19/h6,8-9H,7H2,1-5H3,(H,18,19)
- Oral Bioavailability
- 42.143
- Drug Likeness
- 0.862
- 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 ingredient4 Herbs