01
大黄
Da Huang / Radix et Rhizoma Rhei; Rhei Radix et Rhizoma
Da HuangRadix et Rhizoma Rhei; Rhei Radix et Rhizoma
Ingredients
1,8-dihydroxy-3-methoxy-2,6-dimethyl-9,10-anthraquinone
C17H14O5
- Entity Type
- Ingredients
- Relation Groups
- 2
- Relation Preview
- 9
Basic Information
Grouped by core information, identifiers, and descriptions.
Core Information
- Name
- 1,8-dihydroxy-3-methoxy-2,6-dimethyl-9,10-anthraquinone
- Molecular Formula
- C17H14O5
- Molecular Weight
- No data
- Canonical SMILES
- CC1=CC2=C(C(=C1)O)C(=O)C3=C(C(=C(C=C3C2=O)OC)C)O
- Isomeric SMILES
- CC1=CC2=C(C(=C1)O)C(=O)C3=C(C(=C(C=C3C2=O)OC)C)O
- InChI
- InChI=1S/C17H14O5/c1-7-4-9-13(11(18)5-7)17(21)14-10(16(9)20)6-12(22-3)8(2)15(14)19/h4-6,18-19H,1-3H3
- Oral Bioavailability
- 5.533
- Drug Likeness
- 0.721
- 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