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

ORQ

Summary
Name:N~5~-ACETYL-L-ORNITHINE
Formula:C7 H14 N2 O3
Formal charge:0
Formula weight:174.198 Da
Component type:L-PEPTIDE LINKING

Chemical Identifiers

ProgramVersionName
ACDLabs10.04N~5~-acetyl-L-ornithine
OpenEye OEToolkits1.5.0(2S)-5-acetamido-2-amino-pentanoic acid

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs10.04O=C(NCCCC(N)C(=O)O)C
SMILES_CANONICALCACTVS3.341CC(=O)NCCC[C@H](N)C(O)=O
SMILESCACTVS3.341CC(=O)NCCC[CH](N)C(O)=O
SMILES_CANONICALOpenEye OEToolkits1.5.0CC(=O)NCCC[C@@H](C(=O)O)N
SMILESOpenEye OEToolkits1.5.0CC(=O)NCCCC(C(=O)O)N
InChIInChI1.03InChI=1S/C7H14N2O3/c1-5(10)9-4-2-3-6(8)7(11)12/h6H,2-4,8H2,1H3,(H,9,10)(H,11,12)/t6-/m0/s1
InChIKeyInChI1.03SRXKAYJJGAAOBP-LURJTMIESA-N

222415

PDB entries from 2024-07-10

PDB statisticsPDBj update infoContact PDBjnumon