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Concept information

Preferred term

alpha-neup5ac-(2->3)-beta-d-galp-(1->4)-[alpha-l-fucp-(1->3)]-d-glcpnac-(1->2)-alpha-d-manp  

Type

  • http://www.irandoc.ac.ir/onto/irandoc-meta/Concept

charge

  • 0

formula

  • C37H62N2O28

inchi

  • InChI=1S/C37H62N2O28/c1-9-19(48)23(52)25(54)34(59-9)64-29-18(39-11(3)45)33(65-31-24(53)21(50)14(6-41)60-32(31)56)62-16(8-43)27(29)63-35-26(55)30(22(51)15(7-42)61-35)67-37(36(57)58)4-12(46)17(38-10(2)44)28(66-37)20(49)13(47)5-40/h9,12-35,40-43,46-56H,4-8H2,1-3H3,(H,38,44)(H,39,45)(H,57,58)/t9-,12-,13+,14+,15+,16+,17+,18+,19+,20+,21+,22-,23+,24-,25-,26+,27+,28+,29+,30-,31-,32-,33-,34-,35-,37-/m0/s1

inchikey

  • TZJKRWWILKLMOF-HEAFXJEESA-N

mass

  • 982.88480

monoisotopicmass

  • 982.34891

smiles

  • C[C@@H]1O[C@@H](O[C@@H]2[C@@H](NC(C)=O)[C@H](O[C@@H]3[C@@H](O)O[C@H](CO)[C@@H](O)[C@@H]3O)O[C@H](CO)[C@H]2O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O[C@@]3(C[C@H](O)[C@@H](NC(C)=O)[C@@H](O3)[C@H](O)[C@H](O)CO)C(O)=O)[C@H]2O)[C@@H](O)[C@H](O)[C@@H]1O

subset

  • 3_STAR

synonym EXACT

  • 5-acetamido-3,5-dideoxy-D-glycero-alpha-D-galacto-non-2-ulopyranonosyl-(2->3)-beta-D-galactopyranosyl-(1->4)-[6-deoxy-alpha-L-galactopyranosyl-(1->3)]-2-acetamido-2-deoxy-beta-D-glucopyranosyl-(1->2)-alpha-D-mannopyranose
  • 5-acetamido-3,5-dideoxy-D-glycero-alpha-D-galacto-non-2-ulopyranonosyl-(2->3)-beta-D-galactopyranosyl-(1->4)-[alpha-L-fucopyranosyl-(1->3)]-2-acetamido-2-deoxy-beta-D-glucopyranosyl-(1->2)-alpha-D-mannopyranose

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:85879

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