Structure database (LMSD)

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LM IDLMFA01030756
Common NameNorlinolenic acid
Systematic Name8Z,11Z,14Z-heptadecatrienoic acid
SynonymsC17:3n-3,6,9
Exact Mass
264.2089 (neutral)    Calculate m/z:
FormulaC17H28O2
CategoryFatty Acyls [FA]
Main ClassFatty Acids and Conjugates [FA01]
Sub ClassUnsaturated fatty acids [FA0103]
AbbrevFA 17:3
PubChem CID16061034
KEGG IDC16344
CHEBI ID76235
PlantFA ID10065
InChIKeyFAFSAZIEJFMBBY-PDBXOOCHSA-N  Show lipids differing only in stereochemistry/bond geometry
InChI
InChI=1S/C17H28O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17(18)19/h3-4,6-7,9-10H,2,5,8,11-16H2,1H3,(H,18,19)/b4-3-,7-6-,10-9-
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SMILES
C(CCCCCC/C=C\C/C=C\C/C=C\CC)(=O)O
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MS SpectraView MoNA MS spectra     
StatusActive
Calculated physicochemical properties (?):
 Heavy Atoms19Rings0Aromatic Rings0Rotatable Bonds12
 van der Waals
Molecular Volume
309.68Topological Polar
Surface Area
37.30Hydrogen
Bond Donors
1Hydrogen
Bond Acceptors
2
 logP5.27Molar
Refractivity
82.28