RefMet Compound Details

MW structure779 (View MW Metabolite Database details)
RefMet nameNonadeca-10Z-enoic acid
Alternative nameFA 19:1(10Z)
Systematic name10Z-nonadecenoic acid
SMILESCCCCCCCC/C=C\CCCCCCCCC(=O)O   Run Tanimoto similarity search (with similarity coefficient >=0.6)
Sum CompositionFA 19:1 View other entries in RefMet with this sum composition
Exact mass296.271530 (neutral)
Calculate m/z:   
View other RefMet entries with this exact (neutral) mass:   +/- 0.05 amu   +/- 0.1 amu   +/- 0.2 amu   +/- 0.5 amu
FormulaC19H36O2View other entries in RefMet with this formula
InChIInChI=1S/C19H36O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19(20)21/h9-10H,2-8,11-18H2,1H3,(H,20,21)/b10-9-
InChIKeyBBOWBNGUEWHNQZ-KTKRTIGZSA-NView other enantiomers/diastereomers of this metabolite in RefMet
Super ClassFatty Acyls
Main ClassFatty acids
Sub ClassUnsaturated FA
Pubchem CID5312513
Annotation level1   (1:Known structure; 2:Known regiochemistry; 3:Partial structure; 4:Sum-composition)
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