01
- Entity Type
- Ingredients
- Relation Groups
- 2
- Relation Preview
- 3
Basic Information
Grouped by core information, identifiers, and descriptions.
Core Information
- Name
- 4-hydroxybenzoylcholine
- Molecular Formula
- C12H18NO3+
- Molecular Weight
- No data
- Canonical SMILES
- C[N+](C)(C)CCOC(=O)C1=CC=C(C=C1)O
- Isomeric SMILES
- C[N+](C)(C)CCOC(=O)C1=CC=C(C=C1)O
- InChI
- InChI=1S/C12H17NO3/c1-13(2,3)8-9-16-12(15)10-4-6-11(14)7-5-10/h4-7H,8-9H2,1-3H3/p+1
- Oral Bioavailability
- 2.147
- Drug Likeness
- 0.618
- 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