BMRB

Biological Magnetic Resonance Data Bank


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

Lignin_cw_compound_3028

Graphical representations:

lignin_cw_compound_3028 image

Molecular Formula: C22 H30 O7

Natural Isotopic Abundance Mass: 406.4694

Mono-Isotopic Molecular Masses:

  • C12N14: 406.1991533177
  • C13N14: 428.2729597493
  • C12N15: 406.1991533177
  • C13N15: 428.2729597493

InCHi String:

Canonical and Isomeric SMILES: CCCC1=CC(=C(C(=C1)OC)OC(CC2=CC(=C(C(=C2)OC)O)OC)CO)OC

Beilstein
3-(4-hydroxy-3,5-dimethoxyphenyl)-2-(2,5-dimethoxy-4-propylphenoxy)propan-1-ol

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 3028
Miscellaneous Databases and IDs:   n/a

Reference data were obtained primarily from the PubChem database.

Three dimensional molecular rendering uses Jmol.