[English] 日本語
Yorodumi- ChemComp-H5W: 6-{[(3R,4R)-4-{[(3E)-4-(3-fluorophenyl)but-3-en-1-yl]oxy}pyrrolid... -
+Open data
-Basic information
Entry | Database: PDB chemical components / ID: H5W |
---|---|
Name | Name: |
-Chemical information
Composition | Formula: C21H26FN3O / Number of atoms: 52 / Formula weight: 355.449 / Formal charge: 0 | ||
---|---|---|---|
Others | Type: NON-POLYMER / PDB classification: HETAIN / Three letter code: H5W / Ideal coordinates details: Corina / Model coordinates PDB-ID: 3UFR | ||
History |
| ||
External links | UniChem / ChemSpider / PubChem / ZINC / Wikipedia search / Google search |
-Structure visualization
Structure viewer | Molecule: MolmilJmol/JSmol |
---|
-Details
-SMILES
ACDLabs 12.01 | CACTVS 3.370 | OpenEye OEToolkits 1.7.6 | |
---|
-SMILES CANONICAL
CACTVS 3.370 | OpenEye OEToolkits 1.7.6 | |
---|
-InChI
InChI 1.03 |
---|
-InChIKey
InChI 1.03 |
---|
-SYSTEMATIC NAME
ACDLabs 12.01 | OpenEye OEToolkits 1.7.6 | |
---|
-PDB entries
Showing all 1 items
PDB-3ufr:
Structure of rat nitric oxide synthase heme domain in complex with 6-(((3R,4R)-4-(((E)-5-(3-fluorophenyl)pent-4-en-1-yl)oxy)pyrrolidin-3-yl)methyl)-4-methylpyridin-2-amine