01
- Entity Type
- Ingredients
- Relation Groups
- 2
- Relation Preview
- 2
Basic Information
Grouped by core information, identifiers, and descriptions.
Core Information
- Name
- (?)-clusin
- Molecular Formula
- C22H26O7
- Molecular Weight
- No data
- Canonical SMILES
- COC1=CC(=CC(=C1OC)OC)CC2(CC(OC2)O)CC3=CC4=C(C=C3)OCO4
- Isomeric SMILES
- COC1=CC(=CC(=C1OC)OC)CC2(CC(OC2)O)CC3=CC4=C(C=C3)OCO4
- InChI
- InChI=1S/C22H26O7/c1-24-18-7-15(8-19(25-2)21(18)26-3)10-22(11-20(23)27-12-22)9-14-4-5-16-17(6-14)29-13-28-16/h4-8,20,23H,9-13H2,1-3H3
- Oral Bioavailability
- No data
- Drug Likeness
- 0.763
- 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