BMRB

Biological Magnetic Resonance Data Bank


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

Selenomethionine

Graphical representations:

Selenomethionine image

Molecular Formula: C5 H11 N O2 Se

Natural Isotopic Abundance Mass: 196.1063400000

Mono-Isotopic Molecular Masses:

  • C12N14: 196.995500402
  • C13N14: 202.012274591
  • C12N15: 197.992535296
  • C13N15: 203.0093094847

InCHi String: InChI=1S/C5H11NO2Se/c1-9-3-2-4(6)5(7)8/h4H,2-3,6H2,1H3,(H,7,8)

canonical SMILES: C[Se]CCC(C(=O)O)N

IUPAC: IUPAC openeye: IUPAC systematic
2-amino-4-methylselanyl-butanoic acid

IUPAC traditional: IUPAC cas
2-amino-4-methylseleno-butanoic acid

PubChem Substance (SID):   85165095   158422   7713
PubChem Compound (CID):   15103
KEGG: Compound ID   C05335
CAS Registry IDs:   1464-42-2   2578-28-1
PDB Chemical Component   MSE
Miscellaneous Databases and IDs:   ChemIDplus 001464422   EINECS 215-977-0   CCRIS 3970   HSDB 3564

Reference data were obtained primarily from the PubChem database.

Three dimensional molecular rendering uses Jmol.