Loading
PDBj
MenuPDBj@FacebookPDBj@TwitterPDBj@YouTubewwPDB FoundationwwPDB
RCSB PDBPDBeBMRBAdv. SearchSearch help

HHQ

Summary
Name:4-iodanyl-3~{H}-pyridin-2-one
Formula:C5 H4 I N O
Formal charge:0
Formula weight:220.996 Da
Component type:NON-POLYMER

Chemical Identifiers

ProgramVersionName
OpenEye OEToolkits2.0.64-iodanyl-3~{H}-pyridin-2-one

Chemical Descriptors

TypeProgramVersionDescriptor
InChIInChI1.03InChI=1S/C5H4INO/c6-4-1-2-7-5(8)3-4/h1-2H,3H2
InChIKeyInChI1.03GRVSGGNZRNHMQI-UHFFFAOYSA-N
SMILES_CANONICALCACTVS3.385IC1=CC=NC(=O)C1
SMILESCACTVS3.385IC1=CC=NC(=O)C1
SMILES_CANONICALOpenEye OEToolkits2.0.6C1C(=CC=NC1=O)I
SMILESOpenEye OEToolkits2.0.6C1C(=CC=NC1=O)I

221371

PDB entries from 2024-06-19

PDB statisticsPDBj update infoContact PDBjnumon