Structure Database (LMSD)

Common Name
5,8-tetradecadienal
Systematic Name
5,8-tetradecadienal
Synonyms
LM ID
LMFA06000082
Formula
C14H24O
Exact Mass
Calculate m/z
208.182715
Sum Composition
FAL 14:2
Status
Active
Show lipids differing only in stereochemistry/bond geometry

Classification

Category
Main Class
Sub Class
Fatty Acyls [FA]
Fatty aldehydes [FA06]

String Representations

InChiKey (Click to copy)
NGKCMQUFXPQZQW-AVQMFFATSA-N
InChi (Click to copy)
InChI=1S/C14H24O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15/h6-7,9-10,14H,2-5,8,11-13H2,1H3/b7-6+,10-9+
SMILES (Click to copy)
C(CCCC)/C=C/C/C=C/CCCC([H])=O

Other Databases

PubChem CID
5283369

Calculated Physicochemical Properties

Heavy Atoms 15
Rings 0
Aromatic Rings 0
Rotatable Bonds 10
Van der Waals Molecular Volume 251.63
Topological Polar Surface Area 17.07
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 1
logP 4.44
Molar Refractivity 66.95

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Created at
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Updated at
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