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Concept information

Preferred term

alpha-neup5ac-(2->6)-beta-d-galp-(1->4)-beta-d-glcpnac-(1->6)-beta-d-galpnac  

Type

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

formula

  • C33H55N3O24

inchi

  • InChI=1S/C33H55N3O24/c1-9(39)34-17-12(42)4-33(32(52)53,60-28(17)20(44)13(43)5-37)55-8-16-22(46)25(49)26(50)31(58-16)59-27-14(6-38)57-30(19(24(27)48)36-11(3)41)54-7-15-21(45)23(47)18(29(51)56-15)35-10(2)40/h12-31,37-38,42-51H,4-8H2,1-3H3,(H,34,39)(H,35,40)(H,36,41)(H,52,53)/t12-,13+,14+,15+,16+,17+,18+,19+,20+,21-,22-,23+,24+,25-,26+,27+,28+,29+,30+,31-,33+/m0/s1

inchikey

  • GBKKEZSPHOXCMH-PQQNRFHPSA-N

monoisotopicmass

  • 877.31755

smiles

  • CC(=O)N[C@H]1[C@H](O)O[C@H](CO[C@@H]2O[C@H](CO)[C@@H](O[C@@H]3O[C@H](CO[C@@]4(C[C@H](O)[C@@H](NC(C)=O)[C@@H](O4)[C@H](O)[C@H](O)CO)C(O)=O)[C@H](O)[C@H](O)[C@H]3O)[C@H](O)[C@H]2NC(C)=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->6)-beta-D-galactopyranosyl-(1->4)-2-acetamido-2-deoxy-beta-D-glucopyranosyl-(1->6)-2-acetamido-2-deoxy-beta-D-galactopyranose

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:157232

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