01
- Entity Type
- Ingredients
- Relation Groups
- 2
- Relation Preview
- 6
Basic Information
Grouped by core information, identifiers, and descriptions.
Core Information
- Name
- 6-tridecylsalicylic acid
- Molecular Formula
- C20H32O3
- Molecular Weight
- No data
- Canonical SMILES
- CCCCCCCCCCCCCC1=C(C(=CC=C1)O)C(=O)O
- Isomeric SMILES
- CCCCCCCCCCCCCC1=C(C(=CC=C1)O)C(=O)O
- InChI
- InChI=1S/C20H32O3/c1-2-3-4-5-6-7-8-9-10-11-12-14-17-15-13-16-18(21)19(17)20(22)23/h13,15-16,21H,2-12,14H2,1H3,(H,22,23)
- Oral Bioavailability
- 16.992
- Drug Likeness
- 0.442
- 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