Lignin_cw_compound_267

Lignin_cw_compound_267 bmse010177 - Data

Lignin_cw_compound_267 synonyms

Unnamed

Wikipedia:

Graphical representations:

lignin_cw_compound_267

View large 3D structure

Molecular Formula: C24H24O7

Natural Isotopic Abundance Mass: 424.44316

Mono-Isotopic Molecular Masses:

  • C12N14: 424.1522031251
  • C13N14: 448.2327192323
  • C12N15: 424.1522031251
  • C13N15: 448.2327192323

InChI string: InChI=1/C24H24O7/c1-15(25)28-12-4-5-18-6-11-23-21(13-18)22(14-29-16(2)26)24(31-23)19-7-9-20(10-8-19)30-17(3)27/h4-11,13,22,24H,12,14H2,1-3H3/b5-4+

USDA_NMR_database: 267

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)