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Concept information

Preferred term

alpha-neup5ac-(2->3)-[alpha-neup5ac-(2->6)]-alpha-d-galpnac  

Type

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

charge

  • 0

formula

  • C30H49N3O22

has_role

inchi

  • InChI=1S/C30H49N3O22/c1-9(36)31-17-12(39)4-29(27(47)48,53-23(17)20(43)14(41)6-34)51-8-16-22(45)25(19(26(46)52-16)33-11(3)38)55-30(28(49)50)5-13(40)18(32-10(2)37)24(54-30)21(44)15(42)7-35/h12-26,34-35,39-46H,4-8H2,1-3H3,(H,31,36)(H,32,37)(H,33,38)(H,47,48)(H,49,50)/t12-,13-,14+,15+,16+,17+,18+,19+,20+,21+,22-,23+,24+,25+,26-,29+,30-/m0/s1

inchikey

  • JHJJWKBGTKLJMJ-DODZNRSXSA-N

mass

  • 803.71700

monoisotopicmass

  • 803.28077

smiles

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

subset

  • 3_STAR

synonym EXACT

  • 5-acetamido-3,5-dideoxy-D-glycero-alpha-D-galacto-non-2-ulopyranonosyl-(2->3)-[5-acetamido-3,5-dideoxy-D-glycero-alpha-D-galacto-non-2-ulopyranonosyl-(2->6)]-2-acetamido-2-deoxy-alpha-D-galactopyranose

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:71562

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