01
Ingredients
7-methoxy-8-(2'-ethoxy-3'-hydroxy-3'-methybutyl)coumarin
C17H22O5
- Entity Type
- Ingredients
- Relation Groups
- 2
- Relation Preview
- 10
Basic Information
Grouped by core information, identifiers, and descriptions.
Core Information
- Name
- 7-methoxy-8-(2'-ethoxy-3'-hydroxy-3'-methybutyl)coumarin
- Molecular Formula
- C17H22O5
- Molecular Weight
- No data
- Canonical SMILES
- CCOC(C)(C)C(CC1=C(C=CC2=C1OC(=O)C=C2)OC)O
- Isomeric SMILES
- CCOC(C)(C)[C@@H](CC1=C(C=CC2=C1OC(=O)C=C2)OC)O
- InChI
- InChI=1S/C17H22O5/c1-5-21-17(2,3)14(18)10-12-13(20-4)8-6-11-7-9-15(19)22-16(11)12/h6-9,14,18H,5,10H2,1-4H3/t14-/m1/s1
- Oral Bioavailability
- 40.358
- Drug Likeness
- 0.831
- 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