Biological Magnetic Resonance Data Bank

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


Graphical representations:

Dehydrodiisoeugenol image

Molecular Formula: C20 H22 O4

Natural Isotopic Abundance Mass: 326.38628

Mono-Isotopic Molecular Masses:

  • C12N14: 326.1518091946
  • C13N14: 346.2189059506
  • C12N15: 326.1518091946
  • C13N15: 346.2189059506

InCHi String:

Canonical and Isomeric SMILES: CC=CC1=CC2=C(C(=C1)OC)OC(C2C)C3=CC(=C(C=C3)O)OC


PubChem Substance (SID):   111678064
PubChem Compound (CID):   n/a
KEGG: Compound ID   n/a
CAS Registry IDs:   n/a
PDB Chemical Component   n/a
NMR Lignin Database 67
Miscellaneous Databases and IDs:   n/a

Reference data were obtained primarily from the PubChem database.

Three dimensional molecular rendering uses Jmol.