@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:98198> .

<http://rdf-vocabulary.ddialliance.org/xkos#formula> rdfs:label "فرمول"@fa, "formula"@en .
<http://www.irandoc.acir/onto/irandoc/CHEBI:98198>
  skos:prefLabel "3-[3-[(3r)-2-[(r)-tert-butylsulfinyl]-3-(2-hydroxyethyl)-6-(piperidine-1-carbonyl)-1,3-dihydropyrrolo[3,4-c]pyridin-4-yl]phenyl]benzonitrile"@en, "3 [3 [(3R) 2 [(R) ترت بوتیل سولفینیل] 3 (2 هیدروکسی اتیل) 6 (پیپریدین 1 کربونیل) 1،3 دی هیدروپیرولو [3،4 c] پیریدین 4 یل] فنیل] بنزونیتریل"@fa ;
  ns0:inchi "InChI=1S/C32H36N4O3S/c1-32(2,3)40(39)36-21-26-19-27(31(38)35-14-5-4-6-15-35)34-30(29(26)28(36)13-16-37)25-12-8-11-24(18-25)23-10-7-9-22(17-23)20-33/h7-12,17-19,28,37H,4-6,13-16,21H2,1-3H3/t28-,40-/m1/s1" ;
  ns0:monoisotopicmass "556.25081" ;
  a <http://www.irandoc.ac.ir/onto/irandoc-meta/Concept>, skos:Concept ;
  ns0:formula "C32H36N4O3S" ;
  ns0:mass "556.721" ;
  ns0:subset "2_STAR" ;
  ns0:smiles "CC(C)(C)[S@@](=O)N1CC2=CC(=NC(=C2[C@H]1CCO)C3=CC=CC(=C3)C4=CC=CC(=C4)C#N)C(=O)N5CCCCC5" ;
  ns0:inchikey "QJZRVXNBJYVZFW-VAJZRNNVSA-N" ;
  ns0:charge "0" ;
  skos:broader <http://www.irandoc.acir/onto/irandoc/CHEBI:18379> .

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 .