01
- Entity Type
- Ingredients
- Relation Groups
- 2
- Relation Preview
- 9
Basic Information
Grouped by core information, identifiers, and descriptions.
Core Information
- Name
- Kawain
- Molecular Formula
- C14H14O3
- Molecular Weight
- No data
- Canonical SMILES
- COC1=CC(=O)OC(C1)C=CC2=CC=CC=C2
- Isomeric SMILES
- COC1=CC(=O)O[C@H](C1)/C=C/C2=CC=CC=C2
- InChI
- InChI=1S/C14H14O3/c1-16-13-9-12(17-14(15)10-13)8-7-11-5-3-2-4-6-11/h2-8,10,12H,9H2,1H3/b8-7+/t12-/m0/s1
- Oral Bioavailability
- No data
- Drug Likeness
- 0.748
- 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