@prefix rdfs: <http://www.w3.org/2000/01/rdf-schema#> .
@prefix skos: <http://www.w3.org/2004/02/skos/core#> .
@prefix ns0: <http://rdf-vocabulary.ddialliance.org/xkos#> .

<http://rdf-vocabulary.ddialliance.org/xkos#monoisotopicmass> rdfs:label "جرم تک‌ایزوتوپی"@fa, "monoisotopicmass"@en .
<http://www.irandoc.acir/onto/irandoc/CHEBI:18379>
  skos:prefLabel "نیتریل"@fa, "nitrile"@en ;
  a <http://www.irandoc.ac.ir/onto/irandoc-meta/Concept>, skos:Concept ;
  skos:narrower <http://www.irandoc.acir/onto/irandoc/CHEBI:129603> .

<http://rdf-vocabulary.ddialliance.org/xkos#formula> rdfs:label "فرمول"@fa, "formula"@en .
<http://www.irandoc.acir/onto/irandoc/CHEBI:129603>
  skos:broader <http://www.irandoc.acir/onto/irandoc/CHEBI:18379> ;
  ns0:formula "C24H24F3N3O2" ;
  ns0:charge "0" ;
  skos:prefLabel "3-[4-[(2s,3s)-6-acetyl-2-(hydroxymethyl)-1-(3,3,3-trifluoropropyl)-1,6-diazaspiro[3.3]heptan-3-yl]phenyl]benzonitrile"@en, "3 [4 [(2S,3S) 6 استیل 2 (هیدروکسی متیل) 1 (3،3،3 تری فلوئوروپروپیل) 1،6 دیازاسپیرو[3.3] هپتان 3 یل] فنیل] بنزونیتریل"@fa ;
  a <http://www.irandoc.ac.ir/onto/irandoc-meta/Concept>, skos:Concept ;
  ns0:smiles "CC(=O)N1CC2(C1)[C@H]([C@H](N2CCC(F)(F)F)CO)C3=CC=C(C=C3)C4=CC=CC(=C4)C#N" ;
  ns0:mass "443.462" ;
  ns0:inchikey "QZFUSVJIMZSOPS-YADHBBJMSA-N" ;
  ns0:inchi "InChI=1S/C24H24F3N3O2/c1-16(32)29-14-23(15-29)22(21(13-31)30(23)10-9-24(25,26)27)19-7-5-18(6-8-19)20-4-2-3-17(11-20)12-28/h2-8,11,21-22,31H,9-10,13-15H2,1H3/t21-,22+/m1/s1" ;
  ns0:subset "2_STAR" ;
  ns0:monoisotopicmass "443.18206" .

ns0:smiles rdfs:label "اسمایلٓ"@fa, "smiles"@en .
ns0:subset rdfs:label "زیرمجموعه"@fa, "subset"@en .
ns0:inchikey rdfs:label "اینچی‌کی"@fa, "inchikey"@en .
ns0:charge rdfs:label "charge"@en, "بار"@fa .
ns0:inchi rdfs:label "اینچی"@fa, "inchi"@en .
ns0:mass rdfs:label "جرم"@fa, "mass"@en .
