Structure Database (LMSD)

Common Name
7,17-Dimethylnonacosane
Systematic Name
7,17-Dimethylnonacosane
Synonyms
LM ID
LMFA11000488
Formula
C31H64
Exact Mass
Calculate m/z
436.5008
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)
NTKHGHVWYCVWQS-UHFFFAOYSA-N
InChi (Click to copy)
InChI=1S/C31H64/c1-5-7-9-11-12-13-14-16-19-23-28-31(4)29-25-21-18-15-17-20-24-27-30(3)26-22-10-8-6-2/h30-31H,5-29H2,1-4H3
SMILES (Click to copy)
CCCCCCC(C)CCCCCCCCCC(C)CCCCCCCCCCCC

Other Databases

PubChem CID
56936201

Calculated Physicochemical Properties

Heavy Atoms 31
Rings 0
Aromatic Rings 0
Rotatable Bonds 26
Van der Waals Molecular Volume 544.86
Topological Polar Surface Area 0.00
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 0
logP 12.05
Molar Refractivity 145.10

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Created at
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Updated at
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