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Concept information

... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > chalcogen molecular entity > oxygen molecular entity > organooxygen compound > carbohydrates and carbohydrate derivatives > carbohydrate derivative > amino sugar > beta-d-glcpnac-(1->2)-alpha-d-manp-(1->3)-[alpha-d-manp-(1->2)-alpha-d-manp-(1->6)]-beta-d-manp-(1->4)-beta-d-glcpnac-(1->4)-d-glcpnac
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > chalcogen molecular entity > organochalcogen compound > organooxygen compound > carbohydrates and carbohydrate derivatives > carbohydrate derivative > amino sugar > beta-d-glcpnac-(1->2)-alpha-d-manp-(1->3)-[alpha-d-manp-(1->2)-alpha-d-manp-(1->6)]-beta-d-manp-(1->4)-beta-d-glcpnac-(1->4)-d-glcpnac

Preferred term

beta-d-glcpnac-(1->2)-alpha-d-manp-(1->3)-[alpha-d-manp-(1->2)-alpha-d-manp-(1->6)]-beta-d-manp-(1->4)-beta-d-glcpnac-(1->4)-d-glcpnac  

Type

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

charge

  • 0

formula

  • C48H81N3O36

inchi

  • InChI=1S/C48H81N3O36/c1-11(58)49-21-30(67)37(18(8-56)76-42(21)74)83-44-23(51-13(3)60)31(68)38(19(9-57)81-44)84-46-36(73)39(85-48-41(34(71)27(64)17(7-55)80-48)86-43-22(50-12(2)59)29(66)24(61)14(4-52)77-43)28(65)20(82-46)10-75-47-40(33(70)26(63)16(6-54)79-47)87-45-35(72)32(69)25(62)15(5-53)78-45/h14-48,52-57,61-74H,4-10H2,1-3H3,(H,49,58)(H,50,59)(H,51,60)/t14-,15-,16-,17-,18-,19-,20-,21-,22-,23-,24-,25-,26-,27-,28-,29-,30-,31-,32+,33+,34+,35+,36+,37-,38-,39+,40+,41+,42?,43+,44+,45-,46+,47+,48-/m1/s1

inchikey

  • OMNSVRJGDZNXNT-BJDXLTTQSA-N

mass

  • 1276.161

monoisotopicmass

  • 1275.45998

smiles

  • CC(=O)N[C@H]1C(O)O[C@H](CO)[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O[C@@H]3O[C@H](CO[C@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]4O[C@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]4O)[C@@H](O)[C@H](O[C@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]4O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4NC(C)=O)[C@@H]3O)[C@H](O)[C@H]2NC(C)=O)[C@@H]1O

subset

  • 3_STAR

synonym EXACT

  • 2-acetamido-2-deoxy-beta-D-glucopyranosyl-(1->2)-alpha-D-mannopyranosyl-(1->3)-[alpha-D-mannopyranosyl-(1->2)-alpha-D-mannopyranosyl-(1->6)]-beta-D-mannopyranosyl-(1->4)-2-acetamido-2-deoxy-beta-D-glucopyranosyl-(1->4)-2-acetamido-2-deoxy-D-glucopyranose

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:149025

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