RefMet Compound Details

RefMet ID, RefMet name, exact mass and formula
RefMet IDRM0050050
RefMet nameLactitol
Systematic name4-O-beta-D-Galactopyranosyl-D-glucitol
SynonymsPubChem Synonyms
Exact mass344.131865 (neutral)
Calculate m/z:   
View other RefMet entries with this exact (neutral) mass:   +/- 0.05 amu   +/- 0.1 amu   +/- 0.2 amu   +/- 0.5 amu
FormulaC12H24O11View other entries in RefMet with this formula
Molecular descriptors
Molfile71630 (Download molfile/View MW Metabolite Database details)
InChIInChI=1S/C12H24O11/c13-1-4(16)7(18)11(5(17)2-14)23-12-10(21)9(20)8(19)6(3-15)22-12/h4-21H,1-3H2/t4-,5+,6+,7+,8-,9-,10+,11+,12-/m0/
s1
InChIKeyVQHSOMBJVWLPSR-JVCRWLNRSA-NView other enantiomers/diastereomers of this metabolite in RefMet
SMILESC([C@@H]([C@H]([C@@H]([C@@H](CO)O)O[C@H]1[C@@H]([C@H]([C@H]([C@@H](CO)O1)O)O)O)O)O)O
Run Tanimoto similarity search (with similarity coefficient >=0.6)
Chemical/Biochemical Classification
Super ClassCarbohydrates
Main ClassMonosaccharides
Sub ClassSugar alcohols
Distribution of Lactitol in NMDR studies
SpeciesPlot Species distribution
Sample sourcePlot Sample source(tissue) distribution
PlatformPlatform (MS/NMR) used for detection
ChromatographyChromatography methods used for detection
StudiesNMDR Studies reporting Lactitol
External Links
Pubchem CID157355
ChEBI ID75323
HMDB IDHMDB0040937
MetaCyc IDCPD0-2460
EPA CompToxDTXCID10197197
Spectral data for Lactitol standards
MassBank(EU)View MS spectra
Structural annotation level
Annotation level1   (1:Known structure; 2:Known regiochemistry; 3:Partial structure; 4:Sum-composition)
  logo