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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:[(2R,3R,4S)-3,4-dihydroxypyrrolidin-2-yl]methyl-ADP
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Accession:CHEBI:40454 term browser browse the term
Definition:A purine ribonucleoside 5'-diphosphate that has formula C15H24N6O12P2.
Synonyms:exact_synonym: adenosine 5'-(3-{[(2R,3R,4S)-3,4-dihydroxypyrrolidin-2-yl]methyl} dihydrogen diphosphate)
 related_synonym: 5'-O-[(S)-{[(S)-{[(2R,3R,4S)-3,4-DIHYDROXYPYRROLIDIN-2-YL]METHOXY}(HYDROXY)PHOSPHORYL]OXY}(HYDROXY)PHOSPHORYL]ADENOSINE;   Formula=C15H24N6O12P2;   InChI=1S/C15H24N6O12P2/c16-13-9-14(19-4-18-13)21(5-20-9)15-12(25)11(24)8(32-15)3-31-35(28,29)33-34(26,27)30-2-6-10(23)7(22)1-17-6/h4-8,10-12,15,17,22-25H,1-3H2,(H,26,27)(H,28,29)(H2,16,18,19)/t6-,7+,8-,10-,11-,12-,15-/m1/s1;   InChIKey=NDQDTBCXPOIQGT-UHNJQBFTSA-N;   SMILES=Nc1ncnc2n(cnc12)[C@@H]1O[C@H](COP(O)(=O)OP(O)(=O)OC[C@H]2NC[C@H](O)[C@@H]2O)[C@@H](O)[C@H]1O;   adenosine 5'-diphosphate (hydroxymethyl)pyrrolidinediol
 xref: Beilstein:7260839;   PDBeChem:A1R


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  CHEBI ontology 21720
    chemical entity 21718
      atom 21705
        nonmetal atom 21599
          nitrogen atom 19266
            nitrogen molecular entity 19266
              organonitrogen compound 19040
                organonitrogen heterocyclic compound 18034
                  pyrrolidines 2266
                    hydroxypyrrolidine 94
                      dihydroxypyrrolidine 0
                        [(2R,3R,4S)-3,4-dihydroxypyrrolidin-2-yl]methyl-ADP 0
Path 2
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  CHEBI ontology 21720
    subatomic particle 21705
      composite particle 21705
        hadron 21705
          baryon 21705
            nucleon 21705
              atomic nucleus 21705
                atom 21705
                  main group element atom 21622
                    p-block element atom 21622
                      chalcogen 20749
                        oxygen atom 20727
                          oxygen molecular entity 20727
                            hydroxides 20149
                              oxoacid 19436
                                pnictogen oxoacid 10420
                                  phosphorus oxoacid 9284
                                    phosphoric acids 8016
                                      phosphoric acid 8016
                                        phosphoric acid derivative 7679
                                          phosphate 7679
                                            organic phosphate 7678
                                              carbohydrate phosphate 1712
                                                phospho sugar 1635
                                                  aldose phosphate 1633
                                                    aldopentose phosphate 1627
                                                      ribose phosphate 1622
                                                        ribonucleotide 1582
                                                          ribonucleoside 5'-phosphate 596
                                                            ribonucleoside 5'-diphosphate 112
                                                              purine ribonucleoside 5'-diphosphate 96
                                                                [(2R,3R,4S)-3,4-dihydroxypyrrolidin-2-yl]methyl-ADP 0
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