@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:78616>
  skos:prefLabel "کربوهیدرات ها و مشتقات کربوهیدرات"@fa, "carbohydrates and carbohydrate derivatives"@en ;
  a <http://www.irandoc.ac.ir/onto/irandoc-meta/Concept>, skos:Concept ;
  skos:narrower <http://www.irandoc.acir/onto/irandoc/CHEBI:156849> .

<http://www.irandoc.acir/onto/irandoc/CHEBI:156849>
  ns0:subset "2_STAR" ;
  a <http://www.irandoc.ac.ir/onto/irandoc-meta/Concept>, skos:Concept ;
  ns0:charge "0" ;
  ns0:mass "2458.200" ;
  ns0:smiles "S(O[C@@H]1[C@@H](O)[C@H](O[C@H]2[C@H](O)[C@@H](NC(=O)C)[C@H](O[C@H]3[C@@H](O)[C@H](O[C@@H]4O[C@@H]([C@@H](O[C@@H]5O[C@@H]([C@H](O)[C@H](OS(O)(=O)=O)[C@H]5O)CO)[C@H](O)[C@H]4NC(=O)C)CO)[C@H](O[C@@H]3O[C@H]6[C@H](O)[C@H](O[C@@H](O[C@H]7[C@H](O)[C@@H](NC(=O)C)[C@@H](O[C@@H]7CO)O[C@H]8[C@H](O)[C@@H](NC(=O)C)[C@@H](O[C@@H]8CO)O)[C@H]6O)CO[C@H]9O[C@@H]([C@@H](O)[C@H](O)[C@@H]9O[C@@H]%10O[C@@H]([C@@H](O[C@@H]%11O[C@@H]([C@H](O)[C@H](O[C@]%12(O[C@H]([C@H](NC(=O)C)[C@@H](O)C%12)[C@H](O)[C@H](O)CO)C(O)=O)[C@H]%11O)CO)[C@H](O)[C@H]%10NC(=O)C)CO)CO)CO)O[C@@H]2CO)O[C@@H]([C@@H]1O)CO)(O)(=O)=O" ;
  skos:broader <http://www.irandoc.acir/onto/irandoc/CHEBI:78616> ;
  ns0:inchikey "GOTMDGVUJISMFE-NEEFVBFMSA-N" ;
  ns0:synonym_RELATED "WURCS=2.0/6,12,11/[a2122h-1b_1-5_2*NCC/3=O][a1122h-1b_1-5][a1122h-1a_1-5][a2112h-1b_1-5_3*OSO/3=O/3=O][a2112h-1b_1-5][Aad21122h-2a_2-6_5*NCC/3=O]/1-1-2-3-1-4-1-4-3-1-5-6/a4-b1_b4-c1_c3-d1_c6-i1_d2-e1_d4-g1_e4-f1_g4-h1_i2-j1_j4-k1_k3-l2", "5-acetamido-3,5-dideoxy-D-glycero-alpha-D-galacto-non-2-ulopyranosylonic acid-(2->3)-beta-D-galacto-hexopyranosyl-(1->4)-2-acetamido-2-deoxy-beta-D-gluco-hexopyranosyl-(1->2)-alpha-D-manno-hexopyranosyl-(1->6)-[3-O-sulfo-beta-D-galacto-hexopyranosyl-(1->4)-2-acetamido-2-deoxy-beta-D-gluco-hexopyranosyl-(1->2)-[3-O-sulfo-beta-D-galacto-hexopyranosyl-(1->4)-2-acetamido-2-deoxy-beta-D-gluco-hexopyranosyl-(1->4)]-alpha-D-manno-hexopyranosyl-(1->3)]-beta-D-manno-hexopyranosyl-(1->4)-2-acetamido-2-deoxy-beta-D-gluco-hexopyranosyl-(1->4)-2-acetamido-2-deoxy-beta-D-gluco-hexopyranose", "NeuAc(a2-3)Gal(b1-4)GlcNAc(b1-2)Man(a1-6)[Gal3S(b1-4)GlcNAc(b1-2)[Gal3S(b1-4)GlcNAc(b1-4)]Man(a1-3)]Man(b1-4)GlcNAc(b1-4)b-GlcNAc" ;
  ns0:inchi "InChI=1S/C87H144N6O70S2/c1-20(105)88-39-26(111)7-87(86(131)132,160-68(39)45(113)27(112)8-94)161-70-47(115)29(10-96)141-81(59(70)127)154-64-35(16-102)147-78(43(54(64)122)92-24(5)109)158-73-56(124)46(114)28(9-95)144-84(73)139-19-38-50(118)69(58(126)80(150-38)153-63-33(14-100)145-76(41(52(63)120)90-22(3)107)151-62-32(13-99)140-75(130)40(51(62)119)89-21(2)106)157-85-74(159-79-44(93-25(6)110)55(123)66(36(17-103)148-79)156-83-61(129)72(163-165(136,137)138)49(117)31(12-98)143-83)57(125)67(37(18-104)149-85)152-77-42(91-23(4)108)53(121)65(34(15-101)146-77)155-82-60(128)71(162-164(133,134)135)48(116)30(11-97)142-82/h26-85,94-104,111-130H,7-19H2,1-6H3,(H,88,105)(H,89,106)(H,90,107)(H,91,108)(H,92,109)(H,93,110)(H,131,132)(H,133,134,135)(H,136,137,138)/t26-,27+,28+,29+,30+,31+,32+,33+,34+,35+,36+,37+,38+,39+,40+,41+,42+,43+,44+,45+,46+,47-,48-,49-,50+,51+,52+,53+,54+,55+,56-,57-,58-,59+,60+,61+,62+,63+,64+,65+,66+,67+,68+,69-,70-,71-,72-,73-,74-,75+,76-,77-,78-,79-,80-,81-,82-,83-,84-,85+,87-/m0/s1" ;
  skos:prefLabel "(2s,4s,5r,6r)-5-acetamido-2-[(2s,3r,4s,5s,6r)-2-[(2r,3s,4r,5r,6s)-5-acetamido-6-[(2s,3s,4s,5s,6r)-2-[[(2r,3r,4s,5s,6s)-6-[(2r,3s,4r,5r,6s)-5-acetamido-6-[(2r,3s,4r,5r,6r)-5-acetamido-4,6-dihydroxy-2-(hydroxymethyl)oxan-3-yl]oxy-4-hydroxy-2-(hydroxymethyl)oxan-3-yl]oxy-4-[(2r,3s,4s,5s,6r)-3,5-bis[[(2s,3r,4r,5s,6r)-3-acetamido-5-[(2s,3r,4s,5s,6r)-3,5-dihydroxy-6-(hydroxymethyl)-4-sulfooxyoxan-2-yl]oxy-4-hydroxy-6-(hydroxymethyl)oxan-2-yl]oxy]-4-hydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3,5-dihydroxyoxan-2-yl]methoxy]-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl]oxy-4-hydroxy-2-(hydroxymethyl)oxan-3-yl]oxy-3,5-dihydroxy-6-(hydroxymethyl)oxan-4-yl]oxy-4-hydroxy-6-[(1r,2r)-1,2,3-trihydroxypropyl]oxane-2-carboxylic acid"@en, "(2S,4S,5R,6R) 5 استامیدو 2 [(,3R,,5S,)  [(2R,3S,4R,,6S)   6 [(,,,,)  [[(,,,) [(,,,,)    [(,,,,)   4, دی هیدروکسی  ( متیل) اکسان 3 yl]اکسی    ( )   ] ، ، ، ،   بیس[[(,,,,)    [(,,,,) ,    ( )  سولفوکسیوکسان  یل]    ( )      ] ،    ] متوکسی] ،    ( )   ]     ( ) اگزان  ]  ،    ( )   ، ، ، ،  yl1،   تری  پروپیل]   کربوکسیلیک اسید"@fa ;
  ns0:formula "C87H144N6O70S2" ;
  ns0:monoisotopicmass "2456.73341" .

ns0:formula rdfs:label "فرمول"@fa, "formula"@en .
ns0:synonym_RELATED rdfs:label "مترادف مرتبط"@fa, "synonym RELATED"@en .
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:mass rdfs:label "جرم"@fa, "mass"@en .
