Guaiacylglycerol-B-syringyl Ether

Guaiacylglycerol-B-syringyl Ether bmse010520 - Data

Guaiacylglycerol_B_syringyl_ether synonyms

1-(4-hydroxy-3-methoxyphenyl)-2-(2,6-dimethoxyphenoxy)propane-1,3-diol

Wikipedia:

Graphical representations:

Guaiacylglycerol_B_syringyl_ether

View large 3D structure

Molecular Formula: C18H22O7

Natural Isotopic Abundance Mass: 350.36308

Mono-Isotopic Molecular Masses:

  • C12N14: 350.1365530609
  • C13N14: 368.1969401413
  • C12N15: 350.1365530609
  • C13N15: 368.1969401413

InChI string: InChI=1S/C18H22O7/c1-22-13-5-4-6-14(23-2)18(13)25-16(10-19)17(21)11-7-8-12(20)15(9-11)24-3/h4-9,16-17,19-21H,10H2,1-3H3/t16-,17-/m0/s1

USDA_NMR_database: 179

Reference data were obtained primarily from the PubChem database.

Three dimensional molecular rendering uses Jmol.

InChI string and atom numbering calculated using ALATIS (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)