01
- Entity Type
- Ingredients
- Relation Groups
- 2
- Relation Preview
- 11
Basic Information
Grouped by core information, identifiers, and descriptions.
Core Information
- Name
- 2-methoxy-obtusifolin
- Molecular Formula
- C17H14O5
- Molecular Weight
- No data
- Canonical SMILES
- CC1=CC2=C(C(=C1OC)OC)C(=O)C3=C(C2=O)C=CC=C3O
- Isomeric SMILES
- CC1=CC2=C(C(=C1OC)OC)C(=O)C3=C(C2=O)C=CC=C3O
- InChI
- InChI=1S/C17H14O5/c1-8-7-10-13(17(22-3)16(8)21-2)15(20)12-9(14(10)19)5-4-6-11(12)18/h4-7,18H,1-3H3
- Oral Bioavailability
- 24.615
- Drug Likeness
- 0.787
- 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.