charge
label: بار @fa

formula
label: فرمول @fa

inchi
label: اینچی @fa

inchikey
label: اینچی‌کی @fa

mass
label: جرم @fa

monoisotopicmass
label: جرم تک‌ایزوتوپی @fa

smiles
label: اسمایلٓ @fa

subset
label: زیرمجموعه @fa

synonym EXACT
label: مترادف دقیق @fa

(e,e)-2,6-octadienal
type: Concept
charge: 0
formula: C8H12O
inchi: InChI=1S/C8H12O/c1-2-3-4-5-6-7-8-9/h2-3,6-8H,4-5H2,1H3/b3-2+,7-6+
inchikey: CBXNRMOWVZUZQA-BLWKUPHCSA-N
mass: 124.183
monoisotopicmass: 124.08882
smiles: O=C/C=C/CC/C=C/C
subset: 2_STAR
synonym EXACT: (2E,6E)-octa-2,6-dienal
broader: polyunsaturated fatty aldehyde
preferred label: (E,E) 2,6 Octadienal @fa

polyunsaturated fatty aldehyde
type: Concept
narrower: (e,e)-2,6-octadienal
preferred label: آلدئید چرب چند غیر اشباع @fa