Structure Database (LMSD)

Common Name
SFE 15:1(9E)/2:0
Systematic Name
9E-Pentadecenyl acetate
Synonyms
  • SFE(15:1(9E)/2:0)
LM ID
LMFA07010333
Formula
C17H32O2
Exact Mass
Calculate m/z
268.24023
Sum Composition
SFE 17:1
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
Acrobasis vaccinii (#691967)
Insecta (#50557)
Sex pheromone of cranberry fruitworm,Acrobasis vaccinii riley (Lepidoptera: Pyralidae).,
J Chem Ecol, 1994
Pubmed ID: 24241991

String Representations

InChiKey (Click to copy)
HMLSEFMTRSQXGM-BQYQJAHWSA-N
InChi (Click to copy)
InChI=1S/C17H32O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-19-17(2)18/h7-8H,3-6,9-16H2,1-2H3/b8-7+
SMILES (Click to copy)
O(C(=O)C)CCCCCCCC/C=C/CCCCC

Other Databases

CHEBI ID
196109
PubChem CID
19969166

Calculated Physicochemical Properties

Heavy Atoms 19
Rings 0
Aromatic Rings 0
Rotatable Bonds 14
Van der Waals Molecular Volume 314.96
Topological Polar Surface Area 26.30
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 2
logP 5.70
Molar Refractivity 82.72

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Created at
-
Updated at
15th Aug 2023