@prefix skos: <http://www.w3.org/2004/02/skos/core#> .
@prefix rdfs: <http://www.w3.org/2000/01/rdf-schema#> .
@prefix ns0: <http://rdf-vocabulary.ddialliance.org/xkos#> .

<http://www.irandoc.acir/onto/irandoc/CHEBI:48120>
  skos:prefLabel "آنتراسایکلین"@fa, "anthracycline"@en ;
  a <http://www.irandoc.ac.ir/onto/irandoc-meta/Concept>, skos:Concept ;
  skos:narrower <http://www.irandoc.acir/onto/irandoc/CHEBI:222889> .

<http://rdf-vocabulary.ddialliance.org/xkos#formula> rdfs:label "فرمول"@fa, "formula"@en .
<http://www.irandoc.acir/onto/irandoc/CHEBI:222889>
  ns0:inchi "InChI=1S/C80H112N2O37/c1-30-63(89)43(98-13)24-55(103-30)116-74-36(7)109-56(29-78(74,8)82(96)97)115-69-32(3)105-51(23-42(69)85)117-75-62(81(11)12)67(93)77-118-73-39(80(75,10)119-77)21-40(83)59-60(73)64(90)38-20-37-57(65(91)58(38)66(59)92)47(28-79(9,95)61(37)76(94)102-17)110-52-25-45(100-15)71(34(5)106-52)113-50-22-41(84)68(31(2)104-50)112-53-27-46(101-16)72(35(6)108-53)114-54-26-44(99-14)70(33(4)107-54)111-49(88)19-18-48(86)87/h18-21,30-36,41-47,50-56,61-63,67-72,74-75,77,83-85,89,91,93,95H,22-29H2,1-17H3,(H,86,87)/b19-18+/t30-,31+,32-,33+,34+,35+,36+,41+,42-,43-,44+,45-,46+,47+,50-,51-,52-,53-,54-,55+,56-,61-,62+,63+,67+,68-,69+,70-,71-,72-,74+,75-,77-,78+,79-,80-/m0/s1" ;
  ns0:mass "1693.753" ;
  a <http://www.irandoc.ac.ir/onto/irandoc-meta/Concept>, skos:Concept ;
  ns0:charge "0" ;
  ns0:formula "C80H112N2O37" ;
  ns0:subset "2_STAR" ;
  ns0:smiles "O=[N+]([O-])[C@]1([C@H](O[C@H]2O[C@H]([C@@H](O)[C@H](C2)OC)C)[C@H](O[C@H](C1)O[C@H]3[C@@H](O)C[C@H](O[C@@H]4[C@]5(O[C@H](OC6=C5C=C(O)C7=C6C(=O)C8=C(C(O)=C9[C@H](O[C@@H]%10O[C@@H]([C@H](O[C@@H]%11O[C@@H]([C@H](O[C@@H]%12O[C@@H]([C@H](O[C@@H]%13O[C@@H]([C@H](OC(=O)/C=C/C(=O)O)[C@@H](C%13)OC)C)[C@@H](C%12)OC)C)[C@@H](C%11)O)C)[C@H](C%10)OC)C)C[C@@]([C@@H](C9=C8)C(=O)OC)(O)C)C7=O)[C@@H]([C@H]4N(C)C)O)C)O[C@H]3C)C)C" ;
  skos:prefLabel "arugomycin"@en, "آروگومایسین"@fa ;
  ns0:synonym_EXACT "(E)-4-[(2R,3S,4R,6S)-6-[(2R,3S,4R,6S)-6-[(2R,3R,4R,6S)-6-[(2R,3S,4S,6R)-6-[[(1S,10R,12S,13R,21S,22R,23R,24S)-23-(dimethylamino)-4,8,12,22-tetrahydroxy-24-[(2S,4S,5S,6S)-4-hydroxy-5-[(2S,4R,5S,6R)-5-[(2R,4S,5R,6S)-5-hydroxy-4-methoxy-6-methyloxan-2-yl]oxy-4,6-dimethyl-4-nitrooxan-2-yl]oxy-6-methyloxan-2-yl]oxy-13-methoxycarbonyl-1,12-dimethyl-6,17-dioxo-20,25-dioxahexacyclo[19.3.1.02,19.05,18.07,16.09,14]pentacosa-2,4,7(16),8,14,18-hexaen-10-yl]oxy]-4-methoxy-2-methyloxan-3-yl]oxy-4-hydroxy-2-methyloxan-3-yl]oxy-4-methoxy-2-methyloxan-3-yl]oxy-4-methoxy-2-methyloxan-3-yl]oxy-4-oxobut-2-enoic acid" ;
  skos:broader <http://www.irandoc.acir/onto/irandoc/CHEBI:48120> ;
  ns0:inchikey "MWGPOKWHXRTZII-IBBNRVHVSA-N" ;
  ns0:monoisotopicmass "1692.69439" .

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:monoisotopicmass rdfs:label "جرم تک‌ایزوتوپی"@fa, "monoisotopicmass"@en .
ns0:mass rdfs:label "جرم"@fa, "mass"@en .