Structure Database (LMSD)

Common Name
gamma-undecalactone
Systematic Name
4-Undecanolide
Synonyms
  • 5-Heptyl-dihydrofuran-2(3H)-one
LM ID
LMFA07040030
Status
Active
Exact Mass
Calculate m/z
184.14633
Formula
Abbrev



Download as...
MDLMOL SDF CSV TSV
MDLMOL files can be opened in various drawing programs. In ChemDraw, open as filetype "MDL Molfile".

Main

Classification

String Representations

InChiKey (Click to copy)
PHXATPHONSXBIL-UHFFFAOYSA-N
InChi (Click to copy)
InChI=1S/C11H20O2/c1-2-3-4-5-6-7-10-8-9-11(12)13-10/h10H,2-9H2,1H3
SMILES (Click to copy)
C(CCCCC)CC1CCC(=O)O1

References

Comments
Pherobase Semiochemicals

Taxonomy Information

Curated from
NCBI taxonomy class
Reference
Phyllocnistis citrella (#199020)
Insecta (#50557)
Identification, synthesis, and field evaluation of the sex pheromone from the citrus leafminer, Phyllocnistis citrella.,
J Chem Ecol, 2006
Pubmed ID: 16525876

Other Databases

HMDB ID
CHEBI ID
PubChem CID

Calculated Physicochemical Properties

Heavy Atoms 13
Rings 1
Aromatic Rings 0
Rotatable Bonds 6
Van der Waals Molecular Volume 201.44
Topological Polar Surface Area 28.37
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 2
logP 3.34
Molar Refractivity 53.00

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Updated at
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