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ONTOLOGY REPORT - ANNOTATIONS


Term:N-octanoylisoglobotriaosyl ceramide
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Accession:CHEBI:59528 term browser browse the term
Definition:The N-octanoyl derivative of isoglobotriaosyl ceramide.
Synonyms:exact_synonym: N-[(2S,3R,4E)-1-{[alpha-D-galactopyranosyl-(1->3)-beta-D-galactopyranosyl-(1->4)-beta-D-glucopyranosyl]oxy}-3-hydroxyoctadec-4-en-2-yl]octanamide
 related_synonym: Formula=C44H81NO18;   ISOGLOBOTRIHEXOSYLCERAMIDE;   InChI=1S/C44H81NO18/c1-3-5-7-9-10-11-12-13-14-15-16-18-19-21-28(49)27(45-32(50)22-20-17-8-6-4-2)26-58-42-38(56)36(54)40(31(25-48)61-42)62-44-39(57)41(34(52)30(24-47)60-44)63-43-37(55)35(53)33(51)29(23-46)59-43/h19,21,27-31,33-44,46-49,51-57H,3-18,20,22-26H2,1-2H3,(H,45,50)/b21-19+/t27-,28+,29+,30+,31+,33-,34-,35-,36+,37+,38+,39+,40+,41-,42+,43+,44-/m0/s1;   InChIKey=RWHPBLFPAUXKDB-FSBZVHFBSA-N;   SMILES=CCCCCCCCCCCCC\\C=C\\[C@@H](O)[C@H](CO[C@@H]1O[C@H](CO)[C@@H](O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O[C@H]3O[C@H](CO)[C@H](O)[C@H](O)[C@H]3O)[C@H]2O)[C@H](O)[C@H]1O)NC(=O)CCCCCCC
 xref: PDB:2Q7Y;   PDBeChem:IGC;   PMID:18295796 "Europe PMC"


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Term Annotations click to browse term
  CHEBI ontology 828
    role 805
      biological role 805
        epitope 10
          N-octanoylisoglobotriaosyl ceramide 0
Path 2
Term Annotations click to browse term
  CHEBI ontology 828
    subatomic particle 812
      composite particle 812
        hadron 812
          baryon 812
            nucleon 812
              atomic nucleus 812
                atom 812
                  main group element atom 800
                    p-block element atom 797
                      carbon group element atom 769
                        carbon atom 765
                          organic molecular entity 765
                            organic group 354
                              organic divalent group 352
                                organodiyl group 352
                                  carbonyl group 351
                                    carbonyl compound 351
                                      carboxylic acid 237
                                        carboacyl group 154
                                          univalent carboacyl group 154
                                            carbamoyl group 151
                                              carboxamide 151
                                                ceramide 0
                                                  oligoglycosylceramide 0
                                                    glycotriaosylceramide 0
                                                      alpha-D-Gal-(1->3)-beta-D-Gal-(1->4)-beta-D-Glc-(1<->1')-Cer 0
                                                        alpha-D-Galp-(1->3)-beta-D-Galp-(1->4)-beta-D-Glcp-(1<->1')-Cer 0
                                                          N-octanoylisoglobotriaosyl ceramide 0
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