BMRB

Biological Magnetic Resonance Data Bank


A Repository for Data from NMR Spectroscopy on Proteins, Peptides, Nucleic Acids, and other Biomolecules
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Lignin_cw_compound_146

Lignin_cw_compound_146 synonyms

2-(4-Acetyl-2-methoxyphenoxy)-1-(3,4-dimethoxyphenyl)ethanone

Wikipedia:

Graphical representations:

lignin_cw_compound_146 image

Molecular Formula: C19 H20 O6

Natural Isotopic Abundance Mass: 344.3585

Mono-Isotopic Molecular Masses:

  • C12N14: 344.1259883746
  • C13N14: 363.1897302928
  • C12N15: 344.1259883746
  • C13N15: 363.1897302928

InCHi String: InChI=1/C19H20O6/c1-12(20)13-5-8-17(19(9-13)24-4)25-11-15(21)14-6-7-16(22-2)18(10-14)23-3/h5-10H,11H2,1-4H3

Canonical and Isomeric SMILES: SMILES_STRING

Beilstein
2-(4-Acetyl-2-methoxyphenoxy)-1-(3,4-dimethoxyphenyl)ethanone

PubChem Substance (SID):   n/a
PubChem Compound (CID):   n/a
KEGG: Compound ID   n/a
CAS Registry IDs:   n/a
PDB Chemical Component   n/a
NMR Lignin Database 146
Miscellaneous Databases and IDs:   n/a

Reference data were obtained primarily from the PubChem database.

Three dimensional molecular rendering uses Jmol.