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_272 synonyms



Graphical representations:

lignin_cw_compound_272 image

Molecular Formula: C19 H24 O10

Natural Isotopic Abundance Mass: 412.38786

Mono-Isotopic Molecular Masses:

  • C12N14: 412.1369469914
  • C13N14: 431.2006889096
  • C12N15: 412.1369469914
  • C13N15: 431.2006889096

InCHi String:

Canonical and Isomeric SMILES: CC(=O)OCC(C(C1=CC(=C(C(=C1)OC)OC(C)=O)OC)OC(C)=O)OC(C)=O

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 272
Miscellaneous Databases and IDs:   n/a

Reference data were obtained primarily from the PubChem database.

Three dimensional molecular rendering uses Jmol.