[English] 日本語
Yorodumi- ChemComp-Y94: 2-methyl-N-[(1R)-1-(naphthalen-1-yl)ethyl]-5-{[(prop-2-en-1-yl)ca... -
+Open data
-Basic information
Entry | Database: PDB chemical components / ID: Y94 |
---|---|
Name | Name: |
-Chemical information
Composition | Formula: C24H25N3O2 / Number of atoms: 54 / Formula weight: 387.474 / Formal charge: 0 | ||||
---|---|---|---|---|---|
Others | Type: non-polymer / PDB classification: HETAIN / Three letter code: Y94 / Ideal coordinates details: Corina / Model coordinates PDB-ID: 7KOJ | ||||
History |
| ||||
External links | UniChem / PubChem / 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 1.03 |
---|
-InChIKey
InChI 1.03 |
---|
-SYSTEMATIC NAME
ACDLabs 12.01 | OpenEye OEToolkits 2.0.7 | |
---|
-PDB entries
Showing all 1 items
PDB-7koj:
The crystal structure of Papain-Like Protease of SARS CoV-2, C111S mutant, in complex with PLP_Snyder494 inhibitor