Accession Number: pdtdbl00074

Details of the Ligand

Ligand Name : Valeric acid
Systematic Names : Valeric acid; Pentanoic acid; N-Valeric acid; N-Pentanoic acid; Valerianic acid; 1-Butanecarboxylic acid
Molecular Formula : C5H10O2
Molecular Weight : g/mol
IUPAC Name : Pentanoic acid
Canonical SMILES : CCCCC(=O)O
Ligand Description :

Valeric acid or Pentanoic acid is a colorless liquid with a penetrating unpleasant odor. It is found naturally in the perennial flowering plant valerian (Valeriana officinalis), from which it gets its name. Its primary use is in the synthesis of its esters. Volatile esters of valeric acid tend to have pleasant odors and are used in perfumes and cosmetics. Ethyl valerate and pentyl valerate are used as food additives because of their fruity flavors.

Valeric acid appears similar in structure to GHB and the neurotransmitter GABA in that it is a short-chain carboxylic acid, although it lacks the alcohol and amine functional groups that contribute to the biological activities of GHB and GABA, respectively. It differs from valproic acid simply by lacking a 3-carbon side-chain. Mevalonic acid is derived from valeric acid by methylation.

Related Plants :
Ligand Related Dockings :
NA
Ligand References :
  1. https://en.wikipedia.org/wiki/Valeric_acid
  2. https://pubchem.ncbi.nlm.nih.gov/compound/7991
  3. http://chem.sis.nlm.nih.gov/chemidplus/name/valeric%20acid
Valeric acid

Click the image to enlarge