Structure Database (LMSD)

Common Name
10-propyl-5,9-tridecadien-1-ol
Systematic Name
10-propyl-5,9-tridecadien-1-ol
Synonyms
  • 10-propyl-trideca-5,9-dien-1-ol
LM ID
LMFA05000015
Formula
C16H30O
Exact Mass
Calculate m/z
238.229665
Sum Composition
FOH 16:2
Status
Active
Show lipids differing only in stereochemistry/bond geometry

Classification

Category
Main Class
Sub Class
Fatty Acyls [FA]
Fatty alcohols [FA05]

String Representations

InChiKey (Click to copy)
VFBQBIBMXSKCFS-AATRIKPKSA-N
InChi (Click to copy)
InChI=1S/C16H30O/c1-3-12-16(13-4-2)14-10-8-6-5-7-9-11-15-17/h5-6,14,17H,3-4,7-13,15H2,1-2H3/b6-5+
SMILES (Click to copy)
C(/CCC)(\CCC)=C/CC/C=C/CCCCO

Other Databases

CHEBI ID
179693
PubChem CID
5283269

Calculated Physicochemical Properties

Heavy Atoms 17
Rings 0
Aromatic Rings 0
Rotatable Bonds 11
Van der Waals Molecular Volume 288.87
Topological Polar Surface Area 20.23
Hydrogen Bond Donors 1
Hydrogen Bond Acceptors 1
logP 5.30
Molar Refractivity 77.70

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Created at
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Updated at
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