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_2071 synonyms



Graphical representations:

lignin_cw_compound_2071 image

Molecular Formula: C28 H30 O10

Natural Isotopic Abundance Mass: 526.5318

Mono-Isotopic Molecular Masses:

  • C12N14: 526.183897184
  • C13N14: 554.2778326424
  • C12N15: 526.183897184
  • C13N15: 554.2778326424

InCHi String:

Canonical and Isomeric SMILES: COC1=C(C(=CC=C1)OC)O[C@H](COC(C=CC2=CC=C(C=C2)O)=O)[C@@H](C3=CC(=C(C(=C3)OC)O)OC)O

To be defined

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 2071
Miscellaneous Databases and IDs:   n/a

Reference data were obtained primarily from the PubChem database.

Three dimensional molecular rendering uses Jmol.