Structure Database (LMSD)

Common Name
3,7,15-Trimethylpentatriacontane
Systematic Name
3,7,15-Trimethylpentatriacontane
Synonyms
LM ID
LMFA11000379
Formula
C38H78
Exact Mass
Calculate m/z
534.61035
Status
Active
Show lipids differing only in stereochemistry/bond geometry

Classification

Category
Main Class
Sub Class
Fatty Acyls [FA]
Hydrocarbons [FA11]

References

Comments
Pherobase Semiochemicals

String Representations

InChiKey (Click to copy)
QBJBVGIHNZYYBW-UHFFFAOYSA-N
InChi (Click to copy)
InChI=1S/C38H78/c1-6-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-24-27-31-37(4)32-28-25-23-26-29-33-38(5)35-30-34-36(3)7-2/h36-38H,6-35H2,1-5H3
SMILES (Click to copy)
CCC(C)CCCC(C)CCCCCCCC(C)CCCCCCCCCCCCCCCCCCCC

Other Databases

PubChem CID
6430418

Calculated Physicochemical Properties

Heavy Atoms 38
Rings 0
Aromatic Rings 0
Rotatable Bonds 32
Van der Waals Molecular Volume 665.96
Topological Polar Surface Area 0.00
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 0
logP 14.64
Molar Refractivity 177.35

Admin

Created at
-
Updated at
-