[English] 日本語
Yorodumi- ChemComp-S0Q: 2-(1-hydroxy-6-((2-(4-methyl-3-oxopiperazin-1-yl)-2-oxoethyl)carb... -
+Open data
-Basic information
Entry | Database: PDB chemical components / ID: S0Q |
---|---|
Name | Name: Synonyms: 2-[(3S)-6-[[2-(4-methyl-3-oxidanylidene-piperazin-1-yl)-2-oxidanylidene-ethyl]carbamoyl]-1-oxidanyl-3H-2,1-benzoxaborol-3-yl]ethanoic acid |
-Chemical information
Composition | Formula: C17H20BN3O7 / Number of atoms: 48 / Formula weight: 389.168 / Formal charge: 0 | ||||||
---|---|---|---|---|---|---|---|
Others | Type: non-polymer / PDB classification: HETAIN / Three letter code: S0Q / Model coordinates PDB-ID: 7AU8 | ||||||
History |
| ||||||
External links | UniChem / ChemSpider / Wikipedia search / Google search |
-Structure visualization
Structure viewer | Molecule: MolmilJmol/JSmol |
---|
-Details
-SMILES
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 |
---|
-PDB entries
Showing all 1 items
PDB-7au8:
Structure of P. aeruginosa PBP3 in complex with a benzoxaborole (Compound 13)