01
- Entity Type
- Ingredients
- Relation Groups
- 2
- Relation Preview
- 12
Basic Information
Grouped by core information, identifiers, and descriptions.
Core Information
- Name
- Clupanodonic acid
- Molecular Formula
- C22H34O2
- Molecular Weight
- No data
- Canonical SMILES
- CCC=CCC=CCC=CCC=CCC=CCCCCCC(=O)O
- Isomeric SMILES
- CC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCCCCC(=O)O
- InChI
- InChI=1S/C22H34O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22(23)24/h3-4,6-7,9-10,12-13,15-16H,2,5,8,11,14,17-21H2,1H3,(H,23,24)/b4-3-,7-6-,10-9-,13-12-,16-15-
- Oral Bioavailability
- 44.013
- Drug Likeness
- 0.265
- 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