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

HM0

Summary
Name:1-cyclobutylimidazole-2-carboxylic acid
Formula:C8 H10 N2 O2
Formal charge:0
Formula weight:166.177 Da
Component type:non-polymer

Chemical Identifiers

ProgramVersionName
OpenEye OEToolkits2.0.71-cyclobutylimidazole-2-carboxylic acid

Chemical Descriptors

TypeProgramVersionDescriptor
InChIInChI1.03InChI=1S/C8H10N2O2/c11-8(12)7-9-4-5-10(7)6-2-1-3-6/h4-6H,1-3H2,(H,11,12)
InChIKeyInChI1.03NZCLFPVXVQMPNV-UHFFFAOYSA-N
SMILES_CANONICALCACTVS3.385OC(=O)c1nccn1C2CCC2
SMILESCACTVS3.385OC(=O)c1nccn1C2CCC2
SMILES_CANONICALOpenEye OEToolkits2.0.7c1cn(c(n1)C(=O)O)C2CCC2
SMILESOpenEye OEToolkits2.0.7c1cn(c(n1)C(=O)O)C2CCC2

222036

数据于2024-07-03公开中

PDB statisticsPDBj update infoContact PDBjnumon