Structure Database (LMSD)

Common Name
9Z,12Z,15Z,18Z,21Z-tetracosapentaenoic acid
Systematic Name
9Z,12Z,15Z,18Z,21Z-tetracosapentaenoic acid
Synonyms
  • 24:5 (n-3)
  • C24:5n-3,6,9,12,15
  • 24:5n3
LM ID
LMFA01030821
Formula
Exact Mass
Calculate m/z
358.28718
Sum Composition
Status
Active

Main

Classification

String Representations

InChiKey (Click to copy)
NPTIBOCVSPURCS-JLNKQSITSA-N
InChi (Click to copy)
InChI=1S/C24H38O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24(25)26/h3-4,6-7,9-10,12-13,15-16H,2,5,8,11,14,17-23H2,1H3,(H,25,26)/b4-3-,7-6-,10-9-,13-12-,16-15-
SMILES (Click to copy)
C(CCCCCCC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CC)(=O)O

References

Other Databases

HMDB ID
CHEBI ID
PubChem CID
SwissLipids ID
Cayman ID

Calculated Physicochemical Properties

Heavy Atoms 26
Rings 0
Aromatic Rings 0
Rotatable Bonds 17
Van der Waals Molecular Volume 425.50
Topological Polar Surface Area 37.30
Hydrogen Bond Donors 1
Hydrogen Bond Acceptors 2
logP 7.55
Molar Refractivity 114.41

Reactions

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Admin

Created at
-
Updated at
25th Apr 2022