[English] 日本語
Yorodumi- ChemComp-X18: N-[(1S)-1-(5-bromopyridin-2-yl)ethyl]-3-[(2R)-3,3-dimethylbutan-2... -
+Open data
-Basic information
Entry | Database: PDB chemical components / ID: X18 |
---|---|
Name | Name: |
-Chemical information
Composition | Formula: C21H25BrN4O2 / Number of atoms: 53 / Formula weight: 445.353 / Formal charge: 0 | ||||
---|---|---|---|---|---|
Others | Type: non-polymer / PDB classification: HETAIN / Three letter code: X18 / Ideal coordinates details: Corina / Model coordinates PDB-ID: 8SZ3 | ||||
History |
| ||||
External links | UniChem / ChemSpider / Wikipedia search / Google search |
-Structure visualization
Structure viewer | Molecule: MolmilJmol/JSmol |
---|
-Details
-SMILES
ACDLabs 12.01 | CACTVS 3.385 | OpenEye OEToolkits 2.0.7 | |
---|
-SMILES CANONICAL
CACTVS 3.385 | OpenEye OEToolkits 2.0.7 | |
---|
-InChI
InChI 1.06 |
---|
-InChIKey
InChI 1.06 |
---|
-SYSTEMATIC NAME
ACDLabs 12.01 | OpenEye OEToolkits 2.0.7 | ~{ | |
---|
-PDB entries
Showing all 1 items
PDB-8sz3:
Structure of human beta 1,3-N-acetylglucosaminyltransferase 2 with compound 7j