Structure database (LMSD)

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LM IDLMFA03000019
Common Name7Z,10Z,13Z,16Z,19Z-eicosapentaenoic acid
Systematic Name7Z,10Z,13Z,16Z,19Z-eicosapentaenoic acid
Synonyms(7Z,10Z,13Z,16Z)-eicosa-7,10,13,16,19-pentaenoic acid; 20:5n-1
Exact Mass
302.2246 (neutral)    Calculate m/z:
FormulaC20H30O2
CategoryFatty Acyls [FA]
Main ClassEicosanoids [FA03]
Sub ClassOther Eicosanoids [FA0300]
AbbrevFA 20:5
PubChem CID87771207
InChIKeyWXWWHMAUMNQUSF-GJDCDIHCSA-N  Show lipids differing only in stereochemistry/bond geometry
InChI
InChI=1S/C20H30O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20(21)22/h2,4-5,7-8,10-11,13-14H,1,3,6,9,12,15-19H2,(H,21,22)/b5-4-,8-7-,11-10-,14-13-
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SMILES
C(CC/C=C\C/C=C\C/C=C\C/C=C\CC=C)CCC(O)=O
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StatusActive
Calculated physicochemical properties (?):
 Heavy Atoms22Rings0Aromatic Rings0Rotatable Bonds14
 van der Waals
Molecular Volume
356.30Topological Polar
Surface Area
37.30Hydrogen
Bond Donors
1Hydrogen
Bond Acceptors
2
 logP5.99Molar
Refractivity
95.95