Structure Database (LMSD)

Common Name
Dotriacontane
Systematic Name
Dotriacontane
Synonyms
LM ID
LMFA11000570
Formula
C32H66
Exact Mass
Calculate m/z
450.51645
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)
QHMGJGNTMQDRQA-UHFFFAOYSA-N
InChi (Click to copy)
InChI=1S/C32H66/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h3-32H2,1-2H3
SMILES (Click to copy)
CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC

Other Databases

HMDB ID
HMDB0034005
CHEBI ID
36020
PubChem CID
11008

Calculated Physicochemical Properties

Heavy Atoms 32
Rings 0
Aromatic Rings 0
Rotatable Bonds 29
Van der Waals Molecular Volume 562.16
Topological Polar Surface Area 0.00
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 0
logP 12.73
Molar Refractivity 149.86

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Created at
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Updated at
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