BMRB

Biological Magnetic Resonance Data Bank


A Repository for Data from NMR Spectroscopy on Proteins, Peptides, Nucleic Acids, and other Biomolecules
Member of WWPDB

Homoarginine

Graphical representations:

Homoarginine image

Molecular Formula: C7 H16 N4 O2

Natural Isotopic Abundance Mass: 188.22754

Mono-Isotopic Molecular Masses:

  • C12N14: 188.1273257786
  • C13N14: 195.1508096432
  • C12N15: 192.1154653514
  • C13N15: 199.138949216

InCHi String:

canonical SMILES: C(CCN=C(N)N)CC(C(=O)O)N

isomeric SMILES: C(CCN=C(N)N)C[C@@H](C(=O)O)N

PUBCHEM iupac NAME
(2S)-2-amino-6-(diaminomethylideneamino)hexanoic acid

PUBCHEM iupac TRADITIONAL NAME: PUBCHEM iupac OPENEYE NAME
(2S)-2-amino-6-guanidino-hexanoic acid

PUBCHEM iupac CAS NAME
(2S)-2-amino-6-guanidinohexanoic acid

PUBCHEM iupac SYSTEMATIC NAME
(2S)-2-azanyl-6-[bis(azanyl)methylideneamino]hexanoic acid

PubChem Substance (SID):   111677876   152276   5030
PubChem Compound (CID):   9085
KEGG: Compound ID   C01924
CAS Registry IDs:   156-86-5   13094-78-5
PDB Chemical Component   HRG
Miscellaneous Databases and IDs:   CAS 156-86-5   MMCD cq_01229   ChemIDplus 000156865   NIST 760275665

Reference data were obtained primarily from the PubChem database.

Three dimensional molecular rendering uses Jmol.