Structure database (LMSD)

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LM IDLMFA09000001
Common Name10Z,13Z,16Z-nonadecatrienenitrile
Systematic Name10Z,13Z,16Z-nonadecatrienenitrile
Synonyms-
Exact Mass
273.2456 (neutral)    Calculate m/z:
FormulaC19H31N
CategoryFatty Acyls [FA]
Main ClassFatty nitriles [FA09]
Sub Class-
PubChem CID5283466
InChIKeyLBPYBAZSMDVFNV-PDBXOOCHSA-N  Show lipids differing only in stereochemistry/bond geometry
InChIInChI=1S/C19H31N/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20/h3-4,6-7,9-
10H,2,5,8,11-18H2,1H3/b4-3-,7-6-,10-9-
SMILESC(#N)CCCCCCCC/C=C\C/C=C\C/C=C\CC
StatusActive
Calculated physicochemical properties (?):
 Heavy Atoms20Rings0Aromatic Rings0Rotatable Bonds13
 van der Waals
Molecular Volume
335.06Topological Polar
Surface Area
23.79Hydrogen
Bond Donors
0Hydrogen
Bond Acceptors
1
 logP6.49Molar
Refractivity
89.49