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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:1-O-(N-benzyloxycarbonylaminoethyl)-3-O-benzoyl-alpha-anthroside
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Accession:CHEBI:61066 term browser browse the term
Definition:A doubly-protected aminoglycoside composed of glucose deoxygenated at C-4 and C-6 and having a methyl substituent at C-2, a 3-hydroxy-3-methylbutanamide group at C-4, a benzoyl protecting group at C-3 and a benzyloxycarbonyl (Z)-protected aminoethyl group at C-1
Synonyms:exact_synonym: benzyl [2-({3-O-benzoyl-4,6-dideoxy-4-[(3-hydroxy-3-methylbutanoyl)amino]-2-O-methyl-alpha-D-glucopyranosyl}oxy)ethyl]carbamate
 related_synonym: Formula=C29H38N2O9;   InChI=1S/C29H38N2O9/c1-19-23(31-22(32)17-29(2,3)35)24(40-26(33)21-13-9-6-10-14-21)25(36-4)27(39-19)37-16-15-30-28(34)38-18-20-11-7-5-8-12-20/h5-14,19,23-25,27,35H,15-18H2,1-4H3,(H,30,34)(H,31,32)/t19-,23-,24+,25-,27+/m1/s1;   InChIKey=WJXPCJRIOGIVLM-USLKBVJRSA-N;   N-benzyloxycarbonylaminoethyl 3-O-benzoyl-4,6-dideoxy-4-[(3-hydroxy-3-methylbutanoyl)amino]-2-O-methyl-alpha-D-glucoside;   SMILES=CO[C@H]1[C@@H](OCCNC(=O)OCc2ccccc2)O[C@H](C)[C@@H](NC(=O)CC(C)(C)O)[C@@H]1OC(=O)c1ccccc1;   benzyl [2-({3-O-benzoyl-4,6-dideoxy-4-[(3-hydroxy-3-methylbutanoyl)amino]-2-O-methyl-alpha-D-glucosyl}oxy)ethyl]carbamate
 xref: PMID:18155682


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  CHEBI ontology 19801
    role 19747
      biological role 19746
        biochemical role 19251
          metabolite 19228
            fundamental metabolite 12618
              galactose 164
                D-galactose 164
                  D-galactopyranose 164
                    1-O-(N-benzyloxycarbonylaminoethyl)-3-O-benzoyl-alpha-anthroside 0
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  CHEBI ontology 19801
    subatomic particle 19797
      composite particle 19797
        hadron 19797
          baryon 19797
            nucleon 19797
              atomic nucleus 19797
                atom 19797
                  main group element atom 19684
                    p-block element atom 19684
                      carbon group element atom 19583
                        carbon atom 19572
                          organic molecular entity 19572
                            heteroorganic entity 19176
                              organochalcogen compound 18884
                                organooxygen compound 18805
                                  carbohydrates and carbohydrate derivatives 12184
                                    carbohydrate 12184
                                      monosaccharide 4026
                                        aldose 2539
                                          aldohexose 2186
                                            D-aldohexose 2180
                                              D-galactose 164
                                                D-galactopyranose 164
                                                  1-O-(N-benzyloxycarbonylaminoethyl)-3-O-benzoyl-alpha-anthroside 0
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