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

NKG

Summary
Name:N-{[3-hydroxy-6-(naphthalen-1-yl)pyridin-2-yl]carbonyl}glycine
Formula:C18 H14 N2 O4
Formal charge:0
Formula weight:322.315 Da
Component type:NON-POLYMER

Chemical Identifiers

ProgramVersionName
ACDLabs12.01N-{[3-hydroxy-6-(naphthalen-1-yl)pyridin-2-yl]carbonyl}glycine
OpenEye OEToolkits1.7.62-[(6-naphthalen-1-yl-3-oxidanyl-pyridin-2-yl)carbonylamino]ethanoic acid

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs12.01O=C(NCC(=O)O)c1nc(ccc1O)c3c2ccccc2ccc3
InChIInChI1.03InChI=1S/C18H14N2O4/c21-15-9-8-14(20-17(15)18(24)19-10-16(22)23)13-7-3-5-11-4-1-2-6-12(11)13/h1-9,21H,10H2,(H,19,24)(H,22,23)
InChIKeyInChI1.03CQPTZSBTFPQERZ-UHFFFAOYSA-N
SMILES_CANONICALCACTVS3.385OC(=O)CNC(=O)c1nc(ccc1O)c2cccc3ccccc23
SMILESCACTVS3.385OC(=O)CNC(=O)c1nc(ccc1O)c2cccc3ccccc23
SMILES_CANONICALOpenEye OEToolkits1.7.6c1ccc2c(c1)cccc2c3ccc(c(n3)C(=O)NCC(=O)O)O
SMILESOpenEye OEToolkits1.7.6c1ccc2c(c1)cccc2c3ccc(c(n3)C(=O)NCC(=O)O)O

222926

PDB entries from 2024-07-24

PDB statisticsPDBj update infoContact PDBjnumon