01
- Entity Type
- Ingredients
- Relation Groups
- 2
- Relation Preview
- 10
Basic Information
Grouped by core information, identifiers, and descriptions.
Core Information
- Name
- 2-benzo[1,3]dioxol-5-yl-5,7-dimethoxy-chroman
- Molecular Formula
- C18H18O5
- Molecular Weight
- No data
- Canonical SMILES
- COC1=CC2=C(CCC(O2)C3=CC4=C(C=C3)OCO4)C(=C1)OC
- Isomeric SMILES
- COC1=CC2=C(CC[C@H](O2)C3=CC4=C(C=C3)OCO4)C(=C1)OC
- InChI
- InChI=1S/C18H18O5/c1-19-12-8-16(20-2)13-4-6-14(23-17(13)9-12)11-3-5-15-18(7-11)22-10-21-15/h3,5,7-9,14H,4,6,10H2,1-2H3/t14-/m0/s1
- Oral Bioavailability
- 57.675
- Drug Likeness
- 0.867
- 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 ingredient2 Herbs