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Concept information

Preferred term

alpha-neup5ac-(2->3)-beta-d-galp-(1->3)-beta-d-glcpnac-(1->3)-beta-d-galp-(1->3)-beta-d-glcpnac  

Type

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

charge

  • 0

formula

  • C39H65N3O29

has_role

inchi

  • InChI=1S/C39H65N3O29/c1-10(48)40-19-13(51)4-39(38(61)62,70-31(19)22(53)14(52)5-43)71-33-26(57)18(9-47)66-37(28(33)59)68-30-21(42-12(3)50)35(64-16(7-45)24(30)55)69-32-25(56)17(8-46)65-36(27(32)58)67-29-20(41-11(2)49)34(60)63-15(6-44)23(29)54/h13-37,43-47,51-60H,4-9H2,1-3H3,(H,40,48)(H,41,49)(H,42,50)(H,61,62)/t13-,14+,15+,16+,17+,18+,19+,20+,21+,22+,23+,24+,25-,26-,27+,28+,29+,30+,31+,32-,33-,34+,35-,36-,37-,39-/m0/s1

inchikey

  • UPEDMSXTWJLMCA-IYKAHFPJSA-N

mass

  • 1039.93610

monoisotopicmass

  • 1039.37037

smiles

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

subset

  • 3_STAR

synonym EXACT

  • 5-acetamido-3,5-dideoxy-D-glycero-alpha-D-galacto-non-2-ulopyranonosyl-(2->3)-beta-D-galactopyranosyl-(1->3)-2-acetamido-2-deoxy-beta-D-glucopyranosyl-(1->3)-beta-D-galactopyranosyl-(1->3)-2-acetamido-2-deoxy-beta-D-glucopyranose

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:71605

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