[English] 日本語
Yorodumi- ChemComp-694: 4-BROMO-3-(CARBOXYMETHOXY)-5-(4-HYDROXYPHENYL)THIOPHENE-2-CARBOXY... -
+Open data
-Basic information
Entry | Database: PDB chemical components / ID: 694 |
---|---|
Name | Name: |
-Chemical information
Composition | Formula: C13H9BrO6S / Number of atoms: 30 / Formula weight: 373.176 / Formal charge: 0 | ||||||
---|---|---|---|---|---|---|---|
Others | Type: NON-POLYMER / PDB classification: HETAIN / Three letter code: 694 / Model coordinates PDB-ID: 2H4G | ||||||
History |
| ||||||
External links | UniChem / ChemSpider / BindingDB / ChEMBL / DrugBank / PubChem / SureChEMBL / ZINC / 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-2h4g:
Crystal structure of PTP1B with monocyclic thiophene inhibitor