01
Ingredients
6-[(3s,5r)-1-methyl-5-methylol-3-piperidyl]-2-pyridone
C12H18N2O2
- Entity Type
- Ingredients
- Relation Groups
- 2
- Relation Preview
- 5
Basic Information
Grouped by core information, identifiers, and descriptions.
Core Information
- Name
- 6-[(3s,5r)-1-methyl-5-methylol-3-piperidyl]-2-pyridone
- Molecular Formula
- C12H18N2O2
- Molecular Weight
- No data
- Canonical SMILES
- CN1CC(CC(C1)C2=CC=CC(=O)N2)CO
- Isomeric SMILES
- CN1C[C@@H](C[C@@H](C1)C2=CC=CC(=O)N2)CO
- InChI
- InChI=1S/C12H18N2O2/c1-14-6-9(8-15)5-10(7-14)11-3-2-4-12(16)13-11/h2-4,9-10,15H,5-8H2,1H3,(H,13,16)/t9-,10+/m1/s1
- Oral Bioavailability
- 69.552
- Drug Likeness
- 0.761
- 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 ingredient4 Herbs
02
03
苦参
Ku Shen / Radix Sophorae Flavescentis; Sophorae Flavescentis Radix
Ku ShenRadix Sophorae Flavescentis; Sophorae Flavescentis Radix
04