01
- Entity Type
- Ingredients
- Relation Groups
- 2
- Relation Preview
- 12
Basic Information
Grouped by core information, identifiers, and descriptions.
Core Information
- Name
- (3r)-4'-methoxy-2',3,7-trihydroxyisoflavanone
- Molecular Formula
- C16H14O6
- Molecular Weight
- No data
- Canonical SMILES
- COC1=CC(=C(C=C1)C2(COC3=C(C2=O)C=CC(=C3)O)O)O
- Isomeric SMILES
- COC1=CC(=C(C=C1)[C@@]2(COC3=C(C2=O)C=CC(=C3)O)O)O
- InChI
- InChI=1S/C16H14O6/c1-21-10-3-5-12(13(18)7-10)16(20)8-22-14-6-9(17)2-4-11(14)15(16)19/h2-7,17-18,20H,8H2,1H3/t16-/m1/s1
- Oral Bioavailability
- 68.862
- Drug Likeness
- 0.779
- 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