01
- Entity Type
- Ingredients
- Relation Groups
- 2
- Relation Preview
- 6
Basic Information
Grouped by core information, identifiers, and descriptions.
Core Information
- Name
- Primin
- Molecular Formula
- C12H16O3
- Molecular Weight
- No data
- Canonical SMILES
- CCCCCC1=CC(=O)C=C(C1=O)OC
- Isomeric SMILES
- CCCCCC1=CC(=O)C=C(C1=O)OC
- InChI
- InChI=1S/C12H16O3/c1-3-4-5-6-9-7-10(13)8-11(15-2)12(9)14/h7-8H,3-6H2,1-2H3
- Oral Bioavailability
- No data
- Drug Likeness
- 0.513
- 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