Structure Database (LMSD)

O O
Common Name
SFE 16:1(8Z,10Z)/2:0
Systematic Name
8Z,10Z-Hexadecadienyl acetate
Synonyms
  • SFE(16:1(8Z,10Z)/2:0)
LM ID
LMFA07010376
Formula
C18H32O2
Exact Mass
Calculate m/z
280.24023
Sum Composition
SFE 18:2
Status
Active
Show lipids differing only in stereochemistry/bond geometry

Main

Classification

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

String Representations

InChiKey (Click to copy)
PYPLKNKCAXASCM-QRLRYFCNSA-N
InChi (Click to copy)
InChI=1S/C18H32O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-20-18(2)19/h7-10H,3-6,11-17H2,1-2H3/b8-7-,10-9-
SMILES (Click to copy)
O(C(=O)C)CCCCCCC/C=C\C=C/CCCCC

References

Comments
Pherobase

Taxonomy Information

Curated from
NCBI taxonomy class
Reference
Pseudexentera (#581523)
Insecta (#50557)
IDENTIFICATION OF SEX PHEROMONE COMPONENTS FOR TWO LEPIDOPTERAN DEFOLIATORS, THE OAK OLETHREUTID LEAFROLLER, PSEUDEXENTERA SPOLIANA (CLEMENS), AND THE ASPEN LEAFROLLER, PSEUDEXENTERA OREGONANA (WALSINGHAM),
Can Entomol, 2012

Other Databases

PubChem CID
5363392

Calculated Physicochemical Properties

Heavy Atoms 20
Rings 0
Aromatic Rings 0
Rotatable Bonds 14
Van der Waals Molecular Volume 329.62
Topological Polar Surface Area 26.30
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 2
logP 5.87
Molar Refractivity 87.25

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Created at
-
Updated at
14th Aug 2023