@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:23219>
  skos:prefLabel "اسید صفراوی تائورین مزدوج"@fa, "bile acid taurine conjugate"@en ;
  a <http://www.irandoc.ac.ir/onto/irandoc-meta/Concept>, skos:Concept ;
  skos:narrower <http://www.irandoc.acir/onto/irandoc/CHEBI:182155> .

<http://rdf-vocabulary.ddialliance.org/xkos#formula> rdfs:label "فرمول"@fa, "formula"@en .
<http://www.irandoc.acir/onto/irandoc/CHEBI:182155>
  ns0:subset "2_STAR" ;
  skos:prefLabel "sulfo((4r)-4-((3r,5s,7r,9s,10s,12s,13r,14s,17r)-3,7,12-trihydroxy-10,13-dimethylhexadecahydro-1h-cyclopenta[a]phenanthren-17-yl)pentanoyl)alanine"@en, "سولفو((4R) 4 ((3R,5S,7R,9S,10S,12S,13R,14S,17R) 3,7,12 تری هیدروکسی 10,13 دی متیل هگزادکاهیدرو 1H سیکلوپنتا[a]فنانترن 17 یل)پنتانینال)"@fa ;
  ns0:mass "559.720" ;
  ns0:inchikey "HTKDGIAMGUMIQO-FXNHETLCSA-N" ;
  ns0:inchi "InChI=1S/C27H45NO9S/c1-14(4-7-23(32)28-20(25(33)34)13-38(35,36)37)17-5-6-18-24-19(12-22(31)27(17,18)3)26(2)9-8-16(29)10-15(26)11-21(24)30/h14-22,24,29-31H,4-13H2,1-3H3,(H,28,32)(H,33,34)(H,35,36,37)/t14-,15+,16-,17-,18+,19+,20?,21-,22+,24+,26+,27-/m1/s1" ;
  a skos:Concept, <http://www.irandoc.ac.ir/onto/irandoc-meta/Concept> ;
  ns0:smiles "S(O)(=O)(=O)CC(NC(=O)CC[C@H]([C@@]1([C@@]2([C@]([C@]3([C@@]([C@@]4([C@](C[C@H]3O)(C[C@H](O)CC4)[H])C)(C[C@@H]2O)[H])[H])(CC1)[H])C)[H])C)C(O)=O" ;
  ns0:formula "C27H45NO9S" ;
  ns0:synonym_EXACT "3-sulo-2-[[(4R)-4-[(3R,5S,7R,8R,9S,10S,12S,13R,14S,17R)-3,7,12-trihydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl]pentanoyl]amino]propanoic acid" ;
  skos:broader <http://www.irandoc.acir/onto/irandoc/CHEBI:23219> ;
  ns0:charge "0" ;
  ns0:monoisotopicmass "559.28150" .

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