3-(4-hydroxy-3-methoxyphenyl)-2-(2-methoxy-4-propylphenoxy)propan-1-ol

3-(4-hydroxy-3-methoxyphenyl)-2-(2-methoxy-4-propylphenoxy)propan-1-ol bmse010349 - Data

Lignin_cw_compound_3025 synonyms

Wikipedia:

Graphical representations:

lignin_cw_compound_3025

View large 3D structure

Molecular Formula: C20H26O5

Natural Isotopic Abundance Mass: 346.41744

Mono-Isotopic Molecular Masses:

  • C12N14: 346.1780239451
  • C13N14: 366.2451207011
  • C12N15: 346.1780239451
  • C13N15: 366.2451207011

InChI string: InChI=1/C20H26O5/c1-4-5-14-7-9-18(20(11-14)24-3)25-16(13-21)10-15-6-8-17(22)19(12-15)23-2/h6-9,11-12,16,21-22H,4-5,10,13H2,1-3H3

USDA_NMR_database: 3025

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)