Structure database (LMSD)

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LM IDLMFA01030886
Common Name19:1(9Z)
Systematic Name9Z-nonadecenoic acid
SynonymsC19:1n-10
Exact Mass
296.2715 (neutral)    Calculate m/z:
FormulaC19H36O2
CategoryFatty Acyls [FA]
Main ClassFatty Acids and Conjugates [FA01]
Sub ClassUnsaturated fatty acids [FA0103]
PubChem CID14275216
CHEBI ID78443
InChIKeyYOKHLRHWEXTWJR-KHPPLWFESA-N  Show lipids differing only in stereochemistry/bond geometry
InChI
InChI=1S/C19H36O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19(20)21/h10-11H,2-9,12-18H2,1H3,(H,20,21)/b11-10-
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SMILES
C(CCCCCCC/C=C\CCCCCCCCC)(=O)O
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MS SpectraView MoNA MS spectra     
StatusActive
ReferencesPhospholipid fatty acids and sterols of two Cinachyrella sponges
from the Saudi Arabian Red Sea:
comparison with Cinachyrella species from other origins
G> Barnathan et al.
Comparative Biochemistry and Physiology
Part B: Biochemistry and Molecular Biology
Volume 135, Issue 2, June 2003, Pages 297-308
Calculated physicochemical properties (?):
 Heavy Atoms21Rings0Aromatic Rings0Rotatable Bonds16
 van der Waals
Molecular Volume
349.56Topological Polar
Surface Area
37.30Hydrogen
Bond Donors
1Hydrogen
Bond Acceptors
2
 logP6.50Molar
Refractivity
91.70