Structure Database (LMSD)

Common Name
octadecyl decanoate
Systematic Name
octadecyl decanoate
Synonyms
  • WE(18:0/10:0)
LM ID
LMFA07010461
Formula
C28H56O2
Exact Mass
Calculate m/z
424.42803
Sum Composition
WE 28:0
Status
Active
Show lipids differing only in stereochemistry/bond geometry

Classification

Category
Main Class
Sub Class
Fatty Acyls [FA]
Fatty esters [FA07]
Wax monoesters [FA0701]

References

Comments
Pherobase Semiochemicals

String Representations

InChiKey (Click to copy)
ZKGRELFDBYFQAZ-UHFFFAOYSA-N
InChi (Click to copy)
InChI=1S/C28H56O2/c1-3-5-7-9-11-12-13-14-15-16-17-18-19-21-23-25-27-30-28(29)26-24-22-20-10-8-6-4-2/h3-27H2,1-2H3
SMILES (Click to copy)
O=C(CCCCCCCCC)OCCCCCCCCCCCCCCCCCC

Other Databases

PubChem CID
118716

Calculated Physicochemical Properties

Heavy Atoms 30
Rings 0
Aromatic Rings 0
Rotatable Bonds 26
Van der Waals Molecular Volume 507.90
Topological Polar Surface Area 26.30
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 2
logP 10.22
Molar Refractivity 133.61

Admin

Created at
-
Updated at
-