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

BE2

Summary
Name:2-AMINOBENZOIC ACID
Formula:C7 H7 N O2
Formal charge:0
Formula weight:137.136 Da
Component type:L-PEPTIDE LINKING

Chemical Identifiers

ProgramVersionName
ACDLabs10.042-aminobenzoic acid
OpenEye OEToolkits1.5.02-aminobenzoic acid

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs10.04O=C(O)c1ccccc1N
SMILES_CANONICALCACTVS3.341Nc1ccccc1C(O)=O
SMILESCACTVS3.341Nc1ccccc1C(O)=O
SMILES_CANONICALOpenEye OEToolkits1.5.0c1ccc(c(c1)C(=O)O)N
SMILESOpenEye OEToolkits1.5.0c1ccc(c(c1)C(=O)O)N
InChIInChI1.03InChI=1S/C7H7NO2/c8-6-4-2-1-3-5(6)7(9)10/h1-4H,8H2,(H,9,10)
InChIKeyInChI1.03RWZYAGGXGHYGMB-UHFFFAOYSA-N

217705

PDB entries from 2024-03-27

PDB statisticsPDBj update infoContact PDBjnumon