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

GUN

Summary
Name:GUANINE
Formula:C5 H5 N5 O
Formal charge:0
Formula weight:151.126 Da
Component type:NON-POLYMER

Chemical Identifiers

ProgramVersionName
ACDLabs10.042-amino-1,9-dihydro-6H-purin-6-one
OpenEye OEToolkits1.5.02-amino-1,9-dihydropurin-6-one

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs10.04O=C1c2ncnc2N=C(N1)N
SMILES_CANONICALCACTVS3.341NC1=Nc2[nH]cnc2C(=O)N1
SMILESCACTVS3.341NC1=Nc2[nH]cnc2C(=O)N1
SMILES_CANONICALOpenEye OEToolkits1.5.0c1[nH]c2c(n1)C(=O)NC(=N2)N
SMILESOpenEye OEToolkits1.5.0c1[nH]c2c(n1)C(=O)NC(=N2)N
InChIInChI1.03InChI=1S/C5H5N5O/c6-5-9-3-2(4(11)10-5)7-1-8-3/h1H,(H4,6,7,8,9,10,11)
InChIKeyInChI1.03UYTPUPDQBNUYGX-UHFFFAOYSA-N

218853

PDB entries from 2024-04-24

PDB statisticsPDBj update infoContact PDBjnumon