Structure Database (LMSD)

Common Name
7,10,13,16,19-docosapentaenoic acid
Systematic Name
7,10,13,16,19-docosapentaenoic acid
Synonyms
  • C22:5n-3,6,9,12,15
LM ID
LMFA01030184
Formula
C22H34O2
Exact Mass
Calculate m/z
330.25588
Sum Composition
FA 22:5
Status
Active
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

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Reactions graph legend

References

Taxonomy Information

Curated from
NCBI taxonomy class
Reference
Homo sapiens (#9606)
Mammalia (#40674)
Lipidomics reveals a remarkable diversity of lipids in human plasma,
J Lipid Res, 2010
Pubmed ID: 20671299

String Representations

InChiKey (Click to copy)
YUFFSWGQGVEMMI-RCHUDCCISA-N
InChi (Click to copy)
InChI=1S/C22H34O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22(23)24/h3-4,6-7,9-10,12-13,15-16H,2,5,8,11,14,17-21H2,1H3,(H,23,24)/b4-3+,7-6+,10-9+,13-12+,16-15+
SMILES (Click to copy)
C(=C/C/C=C/C/C=C/C/C=C/CC)\C/C=C/CCCCCC(=O)O

Other Databases

LIPIDBANK ID
DFA0223
PubChem CID
5282850
PlantFA ID
10415

Calculated Physicochemical Properties

Heavy Atoms 24
Rings 0
Aromatic Rings 0
Rotatable Bonds 15
Van der Waals Molecular Volume 390.90
Topological Polar Surface Area 37.30
Hydrogen Bond Donors 1
Hydrogen Bond Acceptors 2
logP 6.77
Molar Refractivity 105.18

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Created at
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Updated at
25th Apr 2022