01
- Entity Type
- Ingredients
- Relation Groups
- 2
- Relation Preview
- 9
Basic Information
Grouped by core information, identifiers, and descriptions.
Core Information
- Name
- Allo-l-isoleucine
- Molecular Formula
- C6H13NO2
- Molecular Weight
- No data
- Canonical SMILES
- CCC(C)C(C(=O)O)N
- Isomeric SMILES
- CC[C@@H](C)[C@@H](C(=O)O)N
- InChI
- InChI=1S/C6H13NO2/c1-3-4(2)5(7)6(8)9/h4-5H,3,7H2,1-2H3,(H,8,9)/t4-,5+/m1/s1
- Oral Bioavailability
- 55.057
- Drug Likeness
- 0.584
- 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