Structure Database (LMSD)

O OH
Common Name
7Z,11Z,14Z,17Z-Eicosatetraenoic acid
Systematic Name
7Z,11Z,14Z,17Z-Eicosatetraenoic acid
Synonyms
  • 7,11,14,17-Eicosatetraenoic acid, (7Z,11Z,14Z,17Z)
  • Z,Z,Z,Z-7,11,14,17-Eicosatetraenoic acid
  • Eicosa-7c,11c,14c,17c-tetraenoic acid
  • Z,Z,Z,Z-7,11,14,17-Icosatetraenoic acid
LM ID
LMFA01031069
Formula
Exact Mass
Calculate m/z
304.24023
Sum Composition
Status
Active

Main

Classification

String Representations

InChiKey (Click to copy)
IXJFGZLSJJNVKJ-XRPCLMINSA-N
InChi (Click to copy)
InChI=1S/C20H32O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20(21)22/h3-4,6-7,9-10,13-14H,2,5,8,11-12,15-19H2,1H3,(H,21,22)/b4-3-,7-6-,10-9-,14-13-
SMILES (Click to copy)
C(CCCCC/C=C\CC/C=C\C/C=C\C/C=C\CC)(=O)O

References

Other Databases

PubChem CID
PlantFA ID

Calculated Physicochemical Properties

Heavy Atoms 22
Rings 0
Aromatic Rings 0
Rotatable Bonds 14
Van der Waals Molecular Volume 358.94
Topological Polar Surface Area 37.3
Hydrogen Bond Donors 1
Hydrogen Bond Acceptors 2
logP 6.22
Molar Refractivity 96.04

Reactions

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Reactions graph legend

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Created at
-
Updated at
25th Apr 2022