01
苦杏仁
Ku Xing Ren / Semen Armeniacae Amarum; Armeniacae Semen Amarum
Ku Xing RenSemen Armeniacae Amarum; Armeniacae Semen Amarum
- Entity Type
- Ingredients
- Relation Groups
- 2
- Relation Preview
- 10
Basic Information
Grouped by core information, identifiers, and descriptions.
Core Information
- Name
- Stock1n-53032
- Molecular Formula
- C18H19NO3
- Molecular Weight
- No data
- Canonical SMILES
- COC1=C(C2=C3C(CC24C=CC(=O)C=C4)NCCC3=C1)OC
- Isomeric SMILES
- COC1=C(C2=C3[C@@H](CC24C=CC(=O)C=C4)NCCC3=C1)OC
- InChI
- InChI=1S/C18H19NO3/c1-21-14-9-11-5-8-19-13-10-18(6-3-12(20)4-7-18)16(15(11)13)17(14)22-2/h3-4,6-7,9,13,19H,5,8,10H2,1-2H3/t13-/m1/s1
- Oral Bioavailability
- 27.787
- Drug Likeness
- 0.909
- 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