@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:36586>
  skos:prefLabel "ترکیب کربونیل"@fa, "carbonyl compound"@en ;
  a <http://www.irandoc.ac.ir/onto/irandoc-meta/Concept>, skos:Concept ;
  skos:narrower <http://www.irandoc.acir/onto/irandoc/CHEBI:169041> .

<http://rdf-vocabulary.ddialliance.org/xkos#formula> rdfs:label "فرمول"@fa, "formula"@en .
<http://rdf-vocabulary.ddialliance.org/xkos#smiles> rdfs:label "اسمایلٓ"@fa, "smiles"@en .
<http://rdf-vocabulary.ddialliance.org/xkos#subset> rdfs:label "زیرمجموعه"@fa, "subset"@en .
<http://www.irandoc.acir/onto/irandoc/CHEBI:169041>
  ns0:monoisotopicmass "436.28249" ;
  skos:broader <http://www.irandoc.acir/onto/irandoc/CHEBI:36586> ;
  a skos:Concept, <http://www.irandoc.ac.ir/onto/irandoc-meta/Concept> ;
  ns0:formula "C25H40O6" ;
  skos:prefLabel "سیمواستاتین هیدروکسی اسید"@fa, "simvastatin hydroxy acid"@en ;
  ns0:synonym_EXACT "(3R,5R)-7-[(1S,2S,6R,8S,8aR)-8-(2,2-dimethylbutanoyloxy)-2,6-dimethyl-1,2,6,7,8,8a-hexahydronaphthalen-1-yl]-3,5-dihydroxyheptanoic acid" ;
  ns0:inchikey "XWLXKKNPFMNSFA-HGQWONQESA-N" ;
  ns0:charge "0" ;
  ns0:inchi "InChI=1S/C25H40O6/c1-6-25(4,5)24(30)31-21-12-15(2)11-17-8-7-16(3)20(23(17)21)10-9-18(26)13-19(27)14-22(28)29/h7-8,11,15-16,18-21,23,26-27H,6,9-10,12-14H2,1-5H3,(H,28,29)/t15-,16-,18+,19+,20-,21-,23-/m0/s1" ;
  ns0:mass "436.589" ;
  ns0:subset "2_STAR" ;
  ns0:smiles "O([C@@H]1[C@@]2([C@H]([C@H](C=CC2=C[C@@H](C1)C)C)CC[C@@H](O)C[C@@H](O)CC(O)=O)[H])C(=O)C(CC)(C)C" .

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:synonym_EXACT rdfs:label "مترادف دقیق"@fa, "synonym EXACT"@en .
ns0:mass rdfs:label "جرم"@fa, "mass"@en .