Structure Database (LMSD)

Common Name
SFE 22:1(11E)/2:0
Systematic Name
11-Docosenyl acetate
Synonyms
  • SFE(22:1(11E)/2:0)
LM ID
LMFA07010404
Formula
C24H46O2
Exact Mass
Calculate m/z
366.34978
Sum Composition
SFE 24:1
Status
Active
Show lipids differing only in stereochemistry/bond geometry

Classification

Category
Main Class
Sub Class
Fatty Acyls [FA]
Fatty esters [FA07]
Short fatty esters [FA0710]

References

Comments
Pherobase

Taxonomy Information

Curated from
NCBI taxonomy class
Reference
Drosophila paulistorum (#46793)
Insecta (#50557)
Male-specific cuticular compounds of the six Drosophila paulistorum semispecies: structural identification and mating effect.,
J Chem Ecol, 2010
Pubmed ID: 20694528

String Representations

InChiKey (Click to copy)
NIEJCCYMORIFCX-OUKQBFOZSA-N
InChi (Click to copy)
InChI=1S/C24H46O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-26-24(2)25/h12-13H,3-11,14-23H2,1-2H3/b13-12+
SMILES (Click to copy)
O(C(=O)C)CCCCCCCCCC/C=C/CCCCCCCCCC

Other Databases

PubChem CID
44256561

Calculated Physicochemical Properties

Heavy Atoms 26
Rings 0
Aromatic Rings 0
Rotatable Bonds 21
Van der Waals Molecular Volume 436.06
Topological Polar Surface Area 26.30
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 2
logP 8.43
Molar Refractivity 115.04

Admin

Created at
-
Updated at
7th Jul 2023