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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:sLe(x)-C12L
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Accession:CHEBI:190306 term browser browse the term
Definition:An artificial glycosphingolipid composed of the ceramide mimetic C12L (CHEBI:190285) bound to a sialyl Lewis(x) [alpha-Neu5Ac-(2->3)-beta-D-Gal-(1->4)-[alpha-L-Fuc-(1->3)]-D-GlcNAc] oligosaccharide via a beta-linkage.
Synonyms:exact_synonym: (2S)-2-(tetracosanoylamino)dodecyl 5-acetamido-3,5-dideoxy-D-glycero-alpha-D-galacto-non-2-ulopyranonosyl-(2->3)-beta-D-galactopyranosyl-(1->4)-[6-deoxy-alpha-L-galactopyranosyl-(1->3)]-2-acetamido-2-deoxy-beta-D-glucopyranoside
 related_synonym: (2S)-2-(tetracosanoylamino)dodecyl alpha-N-acetylneuraminyl-(2->3)-beta-D-galactosyl-(1->4)-[alpha-L-fucosyl-(1->3)]-N-acetyl-beta-D-glucosaminide;   Formula=C67H123N3O24;   InChI=1S/C67H123N3O24/c1-6-8-10-12-14-16-17-18-19-20-21-22-23-24-25-26-27-28-30-32-34-36-50(78)70-45(35-33-31-29-15-13-11-9-7-2)41-87-63-52(69-44(5)75)61(92-64-57(83)56(82)53(79)42(3)88-64)59(49(40-73)90-63)91-65-58(84)62(55(81)48(39-72)89-65)94-67(66(85)86)37-46(76)51(68-43(4)74)60(93-67)54(80)47(77)38-71/h42,45-49,51-65,71-73,76-77,79-84H,6-41H2,1-5H3,(H,68,74)(H,69,75)(H,70,78)(H,85,86)/t42-,45-,46-,47+,48+,49+,51+,52+,53+,54+,55-,56+,57-,58+,59+,60+,61+,62-,63+,64-,65-,67-/m0/s1;   InChIKey=KLQDJWXIRVBXHN-DWSNLIQXSA-N;   Neu5Acalpha2,3Galbeta1,4(Fucalpha1,3)GlcNAcbeta-C12L;   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](CO)O[C@@H](OC[C@H](CCCCCCCCCC)NC(=O)CCCCCCCCCCCCCCCCCCCCCCC)[C@H](NC(C)=O)[C@H]2O[C@@H]2O[C@@H](C)[C@@H](O)[C@@H](O)[C@@H]2O)[C@@H]1O)C(O)=O)[C@H](O)[C@H](O)CO
 xref: PMID:31827147

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  CHEBI ontology 0
    role 0
      biological role 0
        epitope 0
          sLe(x)-C12L 0
Path 2
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  CHEBI ontology 0
    subatomic particle 0
      composite particle 0
        hadron 0
          baryon 0
            nucleon 0
              atomic nucleus 0
                atom 0
                  main group element atom 0
                    p-block element atom 0
                      carbon group element atom 0
                        carbon atom 0
                          organic molecular entity 0
                            heteroorganic entity 0
                              organochalcogen compound 0
                                organooxygen compound 0
                                  carbohydrates and carbohydrate derivatives 0
                                    carbohydrate 0
                                      oligosaccharide 0
                                        oligosaccharide derivative 0
                                          amino oligosaccharide 0
                                            glucosamine oligosaccharide 0
                                              alpha-Neup5Ac-(2->3)-beta-D-Galp-(1->4)-[alpha-L-Fucp-(1->3)]-D-GlcpNAc 0
                                                alpha-Neup5Ac-(2->3)-beta-D-Galp-(1->4)-[alpha-L-Fucp-(1->3)]-beta-D-GlcpNAc 0
                                                  sLe(x)-C12L 0
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