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

DA2

Summary
Name:NG,NG-DIMETHYL-L-ARGININE
Synonyms:ADMA
Formula:C8 H18 N4 O2
Formal charge:0
Formula weight:202.254 Da
Component type:L-PEPTIDE LINKING

Chemical Identifiers

ProgramVersionName
ACDLabs12.01N~5~-(N,N-dimethylcarbamimidoyl)-L-ornithine
OpenEye OEToolkits1.7.6(2S)-2-azanyl-5-[(N,N-dimethylcarbamimidoyl)amino]pentanoic acid

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs12.01CN(C)C(/NCCCC(N)C(=O)O)=N
InChIInChI1.03InChI=1S/C8H18N4O2/c1-12(2)8(10)11-5-3-4-6(9)7(13)14/h6H,3-5,9H2,1-2H3,(H2,10,11)(H,13,14)/t6-/m0/s1
InChIKeyInChI1.03YDGMGEXADBMOMJ-LURJTMIESA-N
SMILES_CANONICALCACTVS3.385CN(C)C(=N)NCCC[C@H](N)C(O)=O
SMILESCACTVS3.385CN(C)C(=N)NCCC[CH](N)C(O)=O
SMILES_CANONICALOpenEye OEToolkits1.7.6[H]/N=C(/NCCC[C@@H](C(=O)O)N)\N(C)C
SMILESOpenEye OEToolkits1.7.6CN(C)C(=N)NCCCC(C(=O)O)N

218500

PDB entries from 2024-04-17

PDB statisticsPDBj update infoContact PDBjnumon