1-(4-acetoxy-3,5-dimethoxyphenyl)-1,3-diacetoxy-2-(2-methoxyphenoxy)propane

1-(4-acetoxy-3,5-dimethoxyphenyl)-1,3-diacetoxy-2-(2-methoxyphenoxy)propane bmse010260 - Data

Lignin_cw_compound_99 synonyms

Wikipedia:

Graphical representations:

lignin_cw_compound_99

View large 3D structure

Molecular Formula: C24H28O10

Natural Isotopic Abundance Mass: 476.47312

Mono-Isotopic Molecular Masses:

  • C12N14: 476.1682471198
  • C13N14: 500.248763227
  • C12N15: 476.1682471198
  • C13N15: 500.248763227

InChI string: InChI=1S/C24H28O10/c1-14(25)31-13-22(34-19-10-8-7-9-18(19)28-4)23(32-15(2)26)17-11-20(29-5)24(33-16(3)27)21(12-17)30-6/h7-12,22-23H,13H2,1-6H3/t22-,23-/m0/s1

USDA_NMR_database: 99

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)