Loading
PDBj
MenuPDBj@FacebookPDBj@X(formerly Twitter)PDBj@BlueSkyPDBj@YouTubewwPDB FoundationwwPDBDonate
RCSB PDBPDBeBMRBAdv. SearchSearch help

GVE

Summary
Name:METHYL 4-AMINOBUTANOATE
Formula:C5 H11 N O2
Formal charge:0
Formula weight:117.146 Da
Component type:peptide-like

Chemical Identifiers

ProgramVersionName
ACDLabs12.01methyl 4-aminobutanoate
OpenEye OEToolkits1.7.0methyl 4-azanylbutanoate

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs12.01O=C(OC)CCCN
SMILES_CANONICALCACTVS3.370COC(=O)CCCN
SMILESCACTVS3.370COC(=O)CCCN
SMILES_CANONICALOpenEye OEToolkits1.7.0COC(=O)CCCN
SMILESOpenEye OEToolkits1.7.0COC(=O)CCCN
InChIInChI1.03InChI=1S/C5H11NO2/c1-8-5(7)3-2-4-6/h2-4,6H2,1H3
InChIKeyInChI1.03KVQGGLZHHFGHPU-UHFFFAOYSA-N

246704

PDB entries from 2025-12-24

PDB statisticsPDBj update infoContact PDBjnumon