Structure Database (LMSD)

Common Name
6Z,10Z,14Z-Hexadecatrienoic acid
Systematic Name
6Z,10Z,14Z-Hexadecatrienoic acid
Synonyms
  • 6,10,14-Hexadecatrienoic acid, (6Z,10Z,14Z)-
LM ID
LMFA01031104
Formula
C16H26O2
Exact Mass
Calculate m/z
250.19328
Sum Composition
FA 16:3
Status
Active
Show lipids differing only in stereochemistry/bond geometry

Main

Classification

Category
Main Class
Sub Class
Fatty Acyls [FA]
Fatty Acids and Conjugates [FA01]
Unsaturated fatty acids [FA0103]

String Representations

InChiKey (Click to copy)
ZKCRKOCVERWCLP-ATYPIPSVSA-N
InChi (Click to copy)
InChI=1S/C16H26O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16(17)18/h2-3,6-7,10-11H,4-5,8-9,12-15H2,1H3,(H,17,18)/b3-2-,7-6-,11-10-
SMILES (Click to copy)
C(CCCC/C=C\CC/C=C\CC/C=C\C)(=O)O

References

Other Databases

CHEBI ID
168953
PubChem CID
131839772
PlantFA ID
10059

Calculated Physicochemical Properties

Heavy Atoms 18
Rings 0
Aromatic Rings 0
Rotatable Bonds 11
Van der Waals Molecular Volume 292.38
Topological Polar Surface Area 37.3
Hydrogen Bond Donors 1
Hydrogen Bond Acceptors 2
logP 4.88
Molar Refractivity 77.67

Reactions

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Reactions graph legend

Admin

Created at
-
Updated at
25th Apr 2022