BMRB

Biological Magnetic Resonance Data Bank


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

(R)-Lactate ()

bmst000283 Theoretical Data

Entry STAR file: bmst000283.str
Generated Data for: (R)-Lactate
BMRB Entry DOI: doi:10.13018/BMST000283
PDB file: bmst000283

Displaying

Natural Isotopic formula weight:

Theoretically calculated chemical shifts

Shift IDAtom IDValue
1C463.909
2C519.061
3C6184.812
4H72.745
5H86.677
6H95.331
7H102.768
8H112.446
9H122.313

Atom numbering calculated using ALATIS. Citation: Hesam Dashti, William M. Westler, John L. Markley, Hamid R. Eghbalnia, "Unique identifiers for small molecules enable rigorous labeling of their atoms", Scientific Data 4, Article number: 170073 (2017), doi:10.1038/sdata.2017.73, https://www.nature.com/articles/sdata201773