Structure Database (LMSD)

Common Name
7Z,12Z-docosadienoic acid
Systematic Name
7Z,12Z-docosadienoic acid
Synonyms
  • delta7,12-22:2
LM ID
LMFA01031172
Formula
C22H40O2
Exact Mass
Calculate m/z
336.30283
Sum Composition
FA 22:2
Status
Curated
Show lipids differing only in stereochemistry/bond geometry

Classification

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

Reactions

Filter by species:
ⓘ Reactions are shown if the E.C. number of the enzyme catalysing it is annotated in the UniProt database for a species belonging to the selected taxonomic class.
Click on an edge to display the reaction(s).
Reactions graph legend

References

Taxonomy Information

Curated from
NCBI taxonomy class
Reference
Bathysiphon (#212484)
New and Uncommon Fatty Acids in Lipids of Deep-Sea Foraminifera.,
Lipids, 2017
Pubmed ID: 28210982

String Representations

InChiKey (Click to copy)
MZTOQERNLZWLGR-NVNPYIFYSA-N
InChi (Click to copy)
InChI=1S/C22H40O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22(23)24/h10-11,15-16H,2-9,12-14,17-21H2,1H3,(H,23,24)/b11-10-,16-15-
SMILES (Click to copy)
C(CCCCC/C=C\CCC/C=C\CCCCCCCCC)(=O)O

Other Databases

PubChem CID
171119143

Calculated Physicochemical Properties

Heavy Atoms 24
Rings 0
Aromatic Rings 0
Rotatable Bonds 18
Van der Waals Molecular Volume 398.82
Topological Polar Surface Area 37.30
Hydrogen Bond Donors 1
Hydrogen Bond Acceptors 2
logP 7.44
Molar Refractivity 105.46

Admin

Created at
22nd Oct 2019
Updated at
25th Apr 2022