Accession Number: pdtdbl00137

Details of the Ligand

Ligand Name : Ocimene
Systematic Names : Ocimene; Ocimene, (E)-beta-Ocimene; beta-Ocimene; trans-beta-Ocimene; (3E)-3,7-dimethylocta-1,3,6-triene; 3,7-dimethyl-1,3,6-Octatriene; trans-Ocimene
Molecular Formula : C10H16
Molecular Weight : g/mol
IUPAC Name : (3E)-3,7-dimethylocta-1,3,6-triene
Canonical SMILES : CC(=CCC=C(C)C=C)C
Ligand Description :
Ocimenes are a group of isomeric hydrocarbons. The ocimenes are monoterpenes found within a variety of plants and fruits. α-Ocimene and the two β-ocimenes differ in the position of the isolated double bond: it is terminal in the alpha isomer. α-Ocimene is cis-3,7-dimethyl-1,3,7-octatriene. β-Ocimene is trans-3,7-dimethyl-1,3,6-octatriene. β-Ocimene exists in two stereoisomeric forms, cis and trans, with respect to the central double bond. The ocimenes are often found naturally as mixtures of the various forms. The mixture, as well as the pure compounds, are oils with a pleasant odor. They are used in perfumery. Like the related acyclic terpene myrcene, ocimenes are unstable in air. Like other terpenes, the ocimenes are nearly insoluble in water, but soluble in common organic solvents.
Related Plants :
Ligand Related Dockings :
NA
Ligand References :
  1. https://en.wikipedia.org/wiki/Ocimene
  2. http://pubchem.ncbi.nlm.nih.gov/compound/_E_-beta-ocimene
  3. http://chem.sis.nlm.nih.gov/chemidplus/name/ocimene
Ocimene

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