Structure Database (LMSD)

Common Name
5S-hydroxy-4R-decanolide
Systematic Name
5S-hydroxy-4R-decanolide
Synonyms
  • (4R,5S)-5-hydroxy-4-decanolide
LM ID
LMFA07040023
Status
Active
Exact Mass
Calculate m/z
200.141245
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)
BCVDPRNPUNARHZ-VHSXEESVSA-N
InChi (Click to copy)
InChI=1S/C11H20O3/c1-2-3-4-5-6-9(12)10-7-8-11(13)14-10/h9-10,12H,2-8H2,1H3/t9-,10+/m0/s1
SMILES (Click to copy)
C1CC(=O)O[C@H]1[C@@H](O)CCCCCC

References

Comments
Pherobase Semiochemicals

Taxonomy Information

Curated from
NCBI taxonomy class
Reference
Nasonia vitripennis (#7425)
Insecta (#50557)
A male sex pheromone in a parasitic wasp and control of the behavioral response by the female's mating status.,
J Exp Biol, 2007
Pubmed ID: 17562890

Other Databases

CHEBI ID
PubChem CID

Calculated Physicochemical Properties

Heavy Atoms 14
Rings 1
Aromatic Rings 0
Rotatable Bonds 6
Van der Waals Molecular Volume 210.23
Topological Polar Surface Area 48.60
Hydrogen Bond Donors 1
Hydrogen Bond Acceptors 3
logP 2.60
Molar Refractivity 54.90

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Updated at
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