01
橘红
Ju Hong / Exocarpium Citri Rubrum; Citri Exocarpium Rubrum
Ju HongExocarpium Citri Rubrum; Citri Exocarpium Rubrum
- Entity Type
- Ingredients
- Relation Groups
- 2
- Relation Preview
- 8
Basic Information
Grouped by core information, identifiers, and descriptions.
Core Information
- Name
- 16-hydroxycolubrine (beta)
- Molecular Formula
- C22H24N2O4
- Molecular Weight
- No data
- Canonical SMILES
- COC1=CC2=C(C=C1)N3C4C25CCN6C5(CC7C4C(CC3=O)OCC=C7C6)O
- Isomeric SMILES
- COC1=CC2=C(C=C1)N3[C@@H]4C25CCN6C5(CC7C4C(CC3=O)OCC=C7C6)O
- InChI
- InChI=1S/C22H24N2O4/c1-27-13-2-3-16-15(8-13)21-5-6-23-11-12-4-7-28-17-9-18(25)24(16)20(21)19(17)14(12)10-22(21,23)26/h2-4,8,14,17,19-20,26H,5-7,9-11H2,1H3/t14?,17?,19?,20-,21?,22?/m0/s1
- Oral Bioavailability
- 7.816
- Drug Likeness
- 0.747
- 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