[English] 日本語
Yorodumi- ChemComp-23I: N-[(1S,2S,4R)-2-HYDROXY-1-ISOBUTYL-5-({(1S)-1-[(ISOPROPYLAMINO)CA... -
+Open data
-Basic information
Entry | Database: PDB chemical components / ID: 23I |
---|---|
Name | Name: |
-Chemical information
Composition | Formula: C36H55N5O7S / Number of atoms: 104 / Formula weight: 701.916 / Formal charge: 0 | ||||
---|---|---|---|---|---|
Others | Type: NON-POLYMER / PDB classification: HETAIN / Three letter code: 23I / Ideal coordinates details: OpenEye OEToolkits | ||||
History |
| ||||
External links | BindingDB / UniChem / ChEMBL / PubChem / PubChem_TPharma / ZINC / ChemSpider / Wikipedia search / Google search |
-Structure visualization
Structure viewer | Molecule: MolmilJmol/JSmol |
---|
-Details
-SMILES
ACDLabs 10.04 | CACTVS 3.341 | OpenEye OEToolkits 1.5.0 | |
---|
-SMILES CANONICAL
CACTVS 3.341 | OpenEye OEToolkits 1.5.0 | |
---|
-InChI
InChI 1.03 |
---|
-InChIKey
InChI 1.03 |
---|
-SYSTEMATIC NAME
ACDLabs 10.04 | OpenEye OEToolkits 1.5.0 | |
---|
-PDB entries
Showing all 1 items
PDB-2p4j:
Crystal structure of beta-secretase bond to an inhibitor with Isophthalamide Derivatives at P2-P3