01
No data
Shen Chang Chuan Xin Lian / Andrographis Elongata
Shen Chang Chuan Xin LianAndrographis Elongata
- Entity Type
- Ingredients
- Relation Groups
- 2
- Relation Preview
- 13
Basic Information
Grouped by core information, identifiers, and descriptions.
Core Information
- Name
- Andrographolide
- Molecular Formula
- C20H30O5
- Molecular Weight
- No data
- Canonical SMILES
- CC12CCC(C(C1CCC(=C)C2CC=C3C(COC3=O)O)(C)CO)O
- Isomeric SMILES
- C[C@@]12CC[C@H]([C@@]([C@H]1CCC(=C)[C@H]2C/C=C/3\[C@@H](COC3=O)O)(C)CO)O
- InChI
- InChI=1S/C20H30O5/c1-12-4-7-16-19(2,9-8-17(23)20(16,3)11-21)14(12)6-5-13-15(22)10-25-18(13)24/h5,14-17,21-23H,1,4,6-11H2,2-3H3/b13-5+/t14-,15-,16+,17-,19+,20+/m1/s1
- Oral Bioavailability
- No data
- Drug Likeness
- 0.411
- 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.