Lignin_cw_compound_2063

Lignin_cw_compound_2063 bmse010316 - Data

Lignin_cw_compound_2063 synonyms

Dihydroconiferyl 4-hydroxydihydrocinnamate

Wikipedia:

Graphical representations:

lignin_cw_compound_2063

View large 3D structure

Molecular Formula: C19H22O5

Natural Isotopic Abundance Mass: 330.37498

Mono-Isotopic Molecular Masses:

  • C12N14: 330.1467238167
  • C13N14: 349.2104657349
  • C12N15: 330.1467238167
  • C13N15: 349.2104657349

InChI string: InChI=1/C19H22O5/c1-23-18-13-15(6-10-17(18)21)3-2-12-24-19(22)11-7-14-4-8-16(20)9-5-14/h4-6,8-10,13,20-21H,2-3,7,11-12H2,1H3

USDA_NMR_database: 2063

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)