01
Ingredients
3,3'-bis-(3,4-dihydro-4-hydroxy-6-methoxy)-2h-1-benzopyran
C20H22O6
- Entity Type
- Ingredients
- Relation Groups
- 2
- Relation Preview
- 11
Basic Information
Grouped by core information, identifiers, and descriptions.
Core Information
- Name
- 3,3'-bis-(3,4-dihydro-4-hydroxy-6-methoxy)-2h-1-benzopyran
- Molecular Formula
- C20H22O6
- Molecular Weight
- No data
- Canonical SMILES
- COC1=CC2=C(C=C1)OCC(C2O)C3COC4=C(C3O)C=C(C=C4)OC
- Isomeric SMILES
- COC1=CC2=C(C=C1)OC[C@@H]([C@@H]2O)[C@@H]3COC4=C([C@@H]3O)C=C(C=C4)OC
- InChI
- InChI=1S/C20H22O6/c1-23-11-3-5-17-13(7-11)19(21)15(9-25-17)16-10-26-18-6-4-12(24-2)8-14(18)20(16)22/h3-8,15-16,19-22H,9-10H2,1-2H3/t15-,16+,19-,20+
- Oral Bioavailability
- 52.109
- Drug Likeness
- 0.878
- 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.
