Complete assignments of (1)H and (13)C NMR spectral data of nine surfactin isomers

Magn Reson Chem. 2007 Sep;45(9):792-6. doi: 10.1002/mrc.2048.

Abstract

A new surfactin isomer (1) was isolated from a mangrove bacteria strain 'Bacillus sp'. Its structure was identified, and full assignments of (1)H and (13)C NMR spectral data were achieved for the first time by a combination of mass spectrometry and 1D and 2D NMR experiments including DEPT, (1)H-(1)H COSY, HSQC, HMBC, TOCSY, ROESY, and HSQC-TOCSY. The NMR spectral data of eight known analogs (2-9) are also reported.

Publication types

  • Research Support, Non-U.S. Gov't

MeSH terms

  • Amino Acids / analysis
  • Bacillus / chemistry
  • Bromcresol Green / chemistry
  • Dimethyl Sulfoxide
  • Fatty Acids / analysis
  • Indicators and Reagents
  • Isomerism
  • Magnetic Resonance Spectroscopy
  • Peptides, Cyclic / chemistry*
  • Solvents
  • Spectrometry, Mass, Electrospray Ionization

Substances

  • Amino Acids
  • Fatty Acids
  • Indicators and Reagents
  • Peptides, Cyclic
  • Solvents
  • Bromcresol Green
  • Dimethyl Sulfoxide