@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:36963>
  skos:prefLabel "ترکیب اکسیژن ارگانیک"@fa, "organooxygen compound"@en ;
  a <http://www.irandoc.ac.ir/onto/irandoc-meta/Concept>, skos:Concept ;
  skos:narrower <http://www.irandoc.acir/onto/irandoc/CHEBI:200972> .

<http://rdf-vocabulary.ddialliance.org/xkos#formula> rdfs:label "فرمول"@fa, "formula"@en .
<http://www.irandoc.acir/onto/irandoc/CHEBI:200972>
  skos:broader <http://www.irandoc.acir/onto/irandoc/CHEBI:36963> ;
  ns0:charge "0" ;
  ns0:subset "2_STAR" ;
  ns0:mass "849.024" ;
  skos:prefLabel "کریپتوپوریک اسید E"@fa, "cryptoporic acid e"@en ;
  ns0:inchikey "PCFMECNNYYMDRS-CDRSNJODSA-N" ;
  a <http://www.irandoc.ac.ir/onto/irandoc-meta/Concept>, skos:Concept ;
  ns0:inchi "InChI=1S/C45H68O15/c1-26-12-14-32-42(3,24-46)16-10-18-44(32,5)30(26)22-59-37(41(54)57-9)29(21-35(49)50)39(52)60-25-43(4)17-11-19-45(6)31(27(2)13-15-33(43)45)23-58-36(40(53)56-8)28(20-34(47)48)38(51)55-7/h28-33,36-37,46H,1-2,10-25H2,3-9H3,(H,47,48)(H,49,50)/t28-,29?,30-,31-,32-,33-,36?,37?,42-,43-,44+,45+/m0/s1" ;
  ns0:monoisotopicmass "848.45582" ;
  ns0:synonym_EXACT "(3S)-4-[[(1S,4aR,5R,8aS)-5-[[3-[[(1S,4aR,5R,8aS)-5-(hydroxymethyl)-5,8a-dimethyl-2-methylidene-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]methoxy]-2-(carboxymethyl)-4-methoxy-4-oxobutanoyl]oxymethyl]-5,8a-dimethyl-2-methylidene-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]methoxy]-5-methoxy-3-methoxycarbonyl-5-oxopentanoic acid" ;
  ns0:smiles "O=C(OC)C(OC[C@H]1C(=C)CC[C@@H]2[C@@]1(CCC[C@]2(CO)C)C)C(C(=O)OC[C@]3([C@H]4[C@@]([C@H](C(=C)CC4)COC(C(=O)OC)[C@@H](C(=O)OC)CC(=O)O)(CCC3)C)C)CC(=O)O" ;
  ns0:formula "C45H68O15" ;
  ns0:has_functional_parent <http://www.irandoc.acir/onto/irandoc/CHEBI:35743> .

<http://www.irandoc.acir/onto/irandoc/CHEBI:35743>
  skos:prefLabel "اسید پنتا کربوکسیلیک"@fa, "pentacarboxylic acid"@en ;
  a <http://www.irandoc.ac.ir/onto/irandoc-meta/Concept>, skos:Concept .

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:has_functional_parent rdfs:label "والد-عملکردی دارد"@fa, "has_functional_parent"@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 .