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Selenomethionine
SpectraBase Compound ID 3UtTNYCeRWt
InChI InChI=1S/C5H11NO2Se/c1-9-3-2-4(6)5(7)8/h4H,2-3,6H2,1H3,(H,7,8)
InChIKey RJFAYQIBOAGBLC-UHFFFAOYSA-N
Mol Weight 196.12 g/mol
Molecular Formula C5H11NO2Se
Exact Mass 196.995501 g/mol

13C Nuclear Magnetic Resonance (NMR) Spectrum

13C Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID EMD89R8aEV2
Name Selenomethionine
Acquisition Mode SIMULTANEOUS
CAS Registry Number 1464-42-2 2578-28-1
ChEBI ID 27585
Comments Saturated 1 Selenomethionine - Sigma; 100 % D2O 50 mM sodium phosphate 500 uM sodium azide 500 uM DSS - pH 7.4, temperature 298 K
Copyright Database Compilation Copyright © 2021-2024 John Wiley & Sons, Inc. All Rights Reserved.
Data Source Madison Metabolomics Consortium - Qiu Cui, Ian Lewis, Mark E. Anderson, John L. Markley.
Formula C5 H11 N O2 Se
IUPAC Name 2-amino-4-methylselanyl-butanoic acid; 2-amino-4-methylseleno-butanoic acid
InChI InChI=1S/C5H11NO2Se/c1-9-3-2-4(6)5(7)8/h4H,2-3,6H2,1H3,(H,7,8)
InChIKey RJFAYQIBOAGBLC-UHFFFAOYSA-N
KEGG Compound ID C05335
KEGG Pathways PATH: map00450 Selenoamino acid metabolism
PubChem Compound ID 15103
SMILES C[Se]CCC(C(=O)O)N
Source File Reference bmse000291