01
- Entity Type
- Ingredients
- Relation Groups
- 2
- Relation Preview
- 13
Basic Information
Grouped by core information, identifiers, and descriptions.
Core Information
- Name
- 3',7-dihydroxy-2',4'-dimethoxyisoflavan
- Molecular Formula
- C17H18O5
- Molecular Weight
- No data
- Canonical SMILES
- COC1=C(C(=C(C=C1)C2CC3=C(C=C(C=C3)O)OC2)OC)O
- Isomeric SMILES
- COC1=C(C(=C(C=C1)[C@@H]2CC3=C(C=C(C=C3)O)OC2)OC)O
- InChI
- InChI=1S/C17H18O5/c1-20-14-6-5-13(17(21-2)16(14)19)11-7-10-3-4-12(18)8-15(10)22-9-11/h3-6,8,11,18-19H,7,9H2,1-2H3/t11-/m1/s1
- Oral Bioavailability
- No data
- Drug Likeness
- 0.912
- 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
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