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CHEBI ONTOLOGY - ANNOTATIONS

The Chemical Entities of Biological Interest (ChEBI) ontology is downloaded weekly from EMBL-EBI at http://www.ebi.ac.uk/chebi/. The data is made available under the Creative Commons License (CC BY 3.0, http://creativecommons.org/licenses/by/3.0/). For more information see: Degtyarenko et al. (2008) ChEBI: a database and ontology for chemical entities of biological interest. Nucleic Acids Res. 36, D344–D350.
Term:beta-NeupNAc-(2->6)-beta-D-Galp-(1->4)-beta-D-GlcpNAc
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Accession:CHEBI:71945 term browser browse the term
Definition:An amino trisaccharide consisting of an N-acetyl-beta-neuraminyl residue attached to the galactose residue of N-acetyllactosamine via an alpha-(2->6)-linkage.
Synonyms:exact_synonym: 5-acetamido-3,5-dideoxy-D-glycero-beta-D-galacto-non-2-ulopyranonosyl-(2->6)-beta-D-galactopyranosyl-(1->4)-2-acetamido-2-deoxy-beta-D-glucopyranose
 related_synonym: Formula=C25H42N2O19;   InChI=1S/C25H42N2O19/c1-7(30)26-13-9(32)3-25(24(40)41,46-21(13)15(34)10(33)4-28)42-6-12-16(35)18(37)19(38)23(44-12)45-20-11(5-29)43-22(39)14(17(20)36)27-8(2)31/h9-23,28-29,32-39H,3-6H2,1-2H3,(H,26,30)(H,27,31)(H,40,41)/t9-,10+,11+,12+,13+,14+,15+,16-,17+,18-,19+,20+,21+,22+,23-,25-/m0/s1;   InChIKey=RPSBVJXBTXEJJG-BOTDAAFFSA-N;   Neu5Acb2-6Galb1-4GlcNAcb;   Neu5Acb2-6Galbeta1-4GlcNAcbeta;   Neu5Acbeta2-6Galbeta1-4GlcNAcbeta;   O-5-(acetylamino)-3,5-dideoxy-D-glycero-beta-D-galacto-2-nonulopyranonosyl-(2->6)-O-beta-D-galactopyranosyl-(1->4)-2-(acetylamino)-2-deoxy-beta-D-glucopyranose;   SMILES=[H][C@]1(O[C@](C[C@H](O)[C@H]1NC(C)=O)(OC[C@H]1O[C@@H](O[C@H]2[C@H](O)[C@@H](NC(C)=O)[C@H](O)O[C@@H]2CO)[C@H](O)[C@@H](O)[C@H]1O)C(O)=O)[C@H](O)[C@H](O)CO;   WURCS=2.0/3,3,2/[a2122h-1b_1-5_2*NCC/3=O][a2112h-1b_1-5][Aad21122h-2b_2-6_5*NCC/3=O]/1-2-3/a4-b1_b6-c2;   beta-N-acetylneuraminyl-2,6-beta-D-galactosyl-1,4-N-acetyl-beta-D-glucosamine;   beta-NeuNAc-(2->6)-beta-D-Gal-(1->4)-beta-D-GlcNAc
 xref: GlyGen:G34476JC;   GlyTouCan:G34476JC;   PMID:19443021;   PMID:25568069;   PMID:31537530


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  CHEBI ontology 22270
    role 22253
      biological role 22252
        epitope 7184
          beta-NeupNAc-(2->6)-beta-D-Galp-(1->4)-beta-D-GlcpNAc 0
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  CHEBI ontology 22270
    subatomic particle 22263
      composite particle 22242
        hadron 22242
          baryon 22263
            nucleon 22242
              atomic nucleus 22263
                atom 22242
                  main group element atom 22139
                    p-block element atom 22118
                      carbon group element atom 21914
                        carbon atom 21855
                          organic molecular entity 21855
                            heteroorganic entity 21541
                              organochalcogen compound 21034
                                organooxygen compound 20884
                                  carbohydrates and carbohydrate derivatives 16053
                                    carbohydrate 16034
                                      oligosaccharide 623
                                        oligosaccharide derivative 155
                                          amino oligosaccharide 2
                                            glucosamine oligosaccharide 0
                                              beta-NeupNAc-(2->6)-beta-D-Galp-(1->4)-beta-D-GlcpNAc 0
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