01
- Entity Type
- Ingredients
- Relation Groups
- 2
- Relation Preview
- 9
Basic Information
Grouped by core information, identifiers, and descriptions.
Core Information
- Name
- 1,3,6-trihydroxy-2,5,7-trimethoxyxanthone
- Molecular Formula
- C16H14O8
- Molecular Weight
- No data
- Canonical SMILES
- COC1=C(C(=C2C(=C1)C(=O)C3=C(O2)C=C(C(=C3O)OC)O)OC)O
- Isomeric SMILES
- COC1=C(C(=C2C(=C1)C(=O)C3=C(O2)C=C(C(=C3O)OC)O)OC)O
- InChI
- InChI=1S/C16H14O8/c1-21-9-4-6-11(18)10-8(5-7(17)15(22-2)13(10)20)24-14(6)16(23-3)12(9)19/h4-5,17,19-20H,1-3H3
- Oral Bioavailability
- 42.216
- Drug Likeness
- 0.623
- 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
