Accession Number: pdtdbl00072

Details of the Ligand

Ligand Name : Vanillin
Systematic Names : Vanillin; 4-Hydroxy-3-methoxybenzaldehyde; Vanillaldehyde; Vanillic aldehyde; Lioxin
Molecular Formula : C8H8O3
Molecular Weight : g/mol
IUPAC Name : 4-hydroxy-3-methoxybenzaldehyde
Canonical SMILES : COC1=C(C=CC(=C1)C=O)O
Ligand Description :
Vanillin is the primary component of the extract of the vanilla bean. Natural vanillin is extracted from the seed pods of Vanilla planifolia. Synthetic vanillin is now used more often than natural vanilla extract as a flavoring agent in foods, beverages, and pharmaceuticals. Natural "vanilla extract" is a mixture of several hundred different compounds in addition to vanillin. Artificial vanilla flavoring is often a solution of pure vanillin, usually of synthetic origin. Because of the scarcity and expense of natural vanilla extract, synthetic preparation of its predominant component has long been of interest. The first commercial synthesis of vanillin began with the more readily available natural compound eugenol. Today, artificial vanillin is made either from guaiacol or lignin.
Related Plants :
Ligand Related Dockings :
NA
Ligand References :
  1. https://en.wikipedia.org/wiki/Vanillin
  2. https://pubchem.ncbi.nlm.nih.gov/compound/vanillin
  3. http://chem.sis.nlm.nih.gov/chemidplus/name/vanillin
Vanillin

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