01
No data
Li Ji San Chu Mai Ma Qian / Strychnos Triplinervia
Li Ji San Chu Mai Ma QianStrychnos Triplinervia
- Entity Type
- Ingredients
- Relation Groups
- 2
- Relation Preview
- 9
Basic Information
Grouped by core information, identifiers, and descriptions.
Core Information
- Name
- Strychninen-oxide
- Molecular Formula
- C21H22N2O3
- Molecular Weight
- No data
- Canonical SMILES
- C1C[N+]2(CC3=CCOC4CC(=O)N5C6C4C3CC2C61C7=CC=CC=C75)[O-]
- Isomeric SMILES
- C1C[N+]2(CC3=CCO[C@H]4CC(=O)N5[C@H]6[C@H]4[C@H]3C[C@H]2[C@@]61C7=CC=CC=C75)[O-]
- InChI
- InChI=1S/C21H22N2O3/c24-18-10-16-19-13-9-17-21(6-7-23(17,25)11-12(13)5-8-26-16)14-3-1-2-4-15(14)22(18)20(19)21/h1-5,13,16-17,19-20H,6-11H2/t13-,16-,17-,19-,20-,21+,23?/m0/s1
- Oral Bioavailability
- No data
- Drug Likeness
- 0.409
- 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 ingredient5 Herbs
02
03
橘红
Ju Hong / Exocarpium Citri Rubrum; Citri Exocarpium Rubrum
Ju HongExocarpium Citri Rubrum; Citri Exocarpium Rubrum
04
05