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_247

Lignin_cw_compound_247 synonyms

Unnamed

Wikipedia:

Graphical representations:

lignin_cw_compound_247 image

Molecular Formula: C20 H22 O6

Natural Isotopic Abundance Mass: 358.38508

Mono-Isotopic Molecular Masses:

  • C12N14: 358.1416384388
  • C13N14: 378.2087351948
  • C12N15: 358.1416384388
  • C13N15: 378.2087351948

InCHi String: InChI=1/C20H22O6/c1-11-7-15(19(25-13(3)21)17(9-11)23-5)16-8-12(2)10-18(24-6)20(16)26-14(4)22/h7-10H,1-6H3

Canonical and Isomeric SMILES: CC1=CC(=C(C(=C1)OC)OC(C)=O)C2=C(C(=CC(=C2)C)OC)OC(C)=O

Beilstein
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 247
Miscellaneous Databases and IDs:   n/a

Reference data were obtained primarily from the PubChem database.

Three dimensional molecular rendering uses Jmol.