@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://rdf-vocabulary.ddialliance.org/xkos#formula> rdfs:label "فرمول"@fa, "formula"@en .
<http://www.irandoc.acir/onto/irandoc/CHEBI:137537>
  a <http://www.irandoc.ac.ir/onto/irandoc-meta/Concept>, skos:Concept ;
  ns0:synonym_RELATED "3-ketodeoxycholoyl-CoA", "3-oxo-DC-CoA", "3-dehydrodeoxycholoyl-CoA", "12alpha-hydroxy-3-oxocholan-24-oyl-CoA", "3-oxo-deoxycholoyl-CoA", "12alpha-hydroxy-3-oxo-5beta-cholan-24-oyl-CoA" ;
  ns0:formula "C45H72N7O19P3S" ;
  skos:prefLabel "3 oxodeoxycholoyl CoA"@fa, "3-oxodeoxycholoyl-coa"@en ;
  ns0:subset "3_STAR" ;
  ns0:charge "0" ;
  ns0:synonym_EXACT "3'-phosphoadenosine 5'-{3-[(3R)-4-{[3-({2-[(12alpha-hydroxy-3-oxo-5beta-cholan-24-oyl)sulfanyl]ethyl}amino)-3-oxopropyl]amino}-3-hydroxy-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate}" ;
  ns0:inchi "InChI=1S/C45H72N7O19P3S/c1-24(28-9-10-29-27-8-7-25-18-26(53)12-14-44(25,4)30(27)19-32(54)45(28,29)5)6-11-34(56)75-17-16-47-33(55)13-15-48-41(59)38(58)43(2,3)21-68-74(65,66)71-73(63,64)67-20-31-37(70-72(60,61)62)36(57)42(69-31)52-23-51-35-39(46)49-22-50-40(35)52/h22-25,27-32,36-38,42,54,57-58H,6-21H2,1-5H3,(H,47,55)(H,48,59)(H,63,64)(H,65,66)(H2,46,49,50)(H2,60,61,62)/t24-,25-,27+,28-,29+,30+,31-,32+,36-,37-,38+,42-,44+,45-/m1/s1" ;
  skos:broader <http://www.irandoc.acir/onto/irandoc/CHEBI:23218> ;
  ns0:mass "1140.078" ;
  ns0:monoisotopicmass "1139.38166" ;
  ns0:is_conjugate_acid_of <http://www.irandoc.acir/onto/irandoc/CHEBI:136701> ;
  ns0:has_functional_parent <http://www.irandoc.acir/onto/irandoc/CHEBI:88104> ;
  ns0:smiles "[C@@H]1(N2C3=C(C(=NC=N3)N)N=C2)O[C@H](COP(OP(OCC(C)([C@H](C(NCCC(NCCSC(=O)CC[C@@](C)([C@]4(CC[C@@]5([C@@]4([C@H](C[C@@]6([C@]7(CCC(C[C@]7(CC[C@@]56[H])[H])=O)C)[H])O)C)[H])[H])[H])=O)=O)O)C)(=O)O)(=O)O)[C@H]([C@H]1O)OP(O)(O)=O" ;
  ns0:inchikey "DUXMITADCRRTKI-REQADMJUSA-N" .

ns0:synonym_RELATED rdfs:label "مترادف مرتبط"@fa, "synonym RELATED"@en .
ns0:smiles rdfs:label "اسمایلٓ"@fa, "smiles"@en .
<http://www.irandoc.acir/onto/irandoc/CHEBI:88104>
  skos:prefLabel "12 آلفا هیدروکسی 3 اکسو 5 بتا کولان 24 اسید اوئیک"@fa, "12alpha-hydroxy-3-oxo-5beta-cholan-24-oic acid"@en ;
  a <http://www.irandoc.ac.ir/onto/irandoc-meta/Concept>, skos:Concept .

ns0:subset rdfs:label "زیرمجموعه"@fa, "subset"@en .
ns0:is_conjugate_acid_of rdfs:label "اسید-مزدوج-است"@fa, "is_conjugate_acid_of"@en .
ns0:inchikey rdfs:label "اینچی‌کی"@fa, "inchikey"@en .
ns0:has_functional_parent rdfs:label "والد-عملکردی دارد"@fa, "has_functional_parent"@en .
<http://www.irandoc.acir/onto/irandoc/CHEBI:23218>
  skos:prefLabel "choloyl-coas"@en, "choloyl CoAs"@fa ;
  a <http://www.irandoc.ac.ir/onto/irandoc-meta/Concept>, skos:Concept ;
  skos:narrower <http://www.irandoc.acir/onto/irandoc/CHEBI:137537> .

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 .
<http://www.irandoc.acir/onto/irandoc/CHEBI:136701>
  skos:prefLabel "3-oxodeoxycholoyl-coa(4-)"@en, "3 oxodeoxycholoyl CoA(4)"@fa ;
  a <http://www.irandoc.ac.ir/onto/irandoc-meta/Concept>, skos:Concept ;
  ns0:is_conjugate_base_of <http://www.irandoc.acir/onto/irandoc/CHEBI:137537> .

