01
Ingredients
5-[(e)-5-(3-furyl)-2-methyl-pent-2-enyl]-2,3-dimethoxy-p-benzoquinone
C18H20O5
- Entity Type
- Ingredients
- Relation Groups
- 2
- Relation Preview
- 8
Basic Information
Grouped by core information, identifiers, and descriptions.
Core Information
- Name
- 5-[(e)-5-(3-furyl)-2-methyl-pent-2-enyl]-2,3-dimethoxy-p-benzoquinone
- Molecular Formula
- C18H20O5
- Molecular Weight
- No data
- Canonical SMILES
- CC(=CCCC1=COC=C1)CC2=CC(=O)C(=C(C2=O)OC)OC
- Isomeric SMILES
- C/C(=C\CCC1=COC=C1)/CC2=CC(=O)C(=C(C2=O)OC)OC
- InChI
- InChI=1S/C18H20O5/c1-12(5-4-6-13-7-8-23-11-13)9-14-10-15(19)17(21-2)18(22-3)16(14)20/h5,7-8,10-11H,4,6,9H2,1-3H3/b12-5+
- Oral Bioavailability
- 61.797
- Drug Likeness
- 0.571
- 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 ingredient1 Herbs
