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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:5-amino-4a-methyl-1,2,3,4,4a,4b,7,8,8a,8b-decahydro-1,3,6,8-tetraazabiphenylene-2,4,7-trione
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Accession:CHEBI:116698 term browser browse the term
Definition:A member of the class of cyclobutadipyrimidines that is 1,4a,4b,8,8a,8b-hexahydrocyclobuta[1,2-d:4,3-d']dipyrimidine-2,4,7(3H)-trione carrying additional methyl and amino substituents at positions 4a and 5 respectively.
Synonyms:exact_synonym: 5-amino-4a-methyl-1,4a,4b,8,8a,8b-hexahydrocyclobuta[1,2-d:4,3-d']dipyrimidine-2,4,7(3H)-trione
 related_synonym: Formula=C9H11N5O3;   InChI=1S/C9H11N5O3/c1-9-2-3(11-7(16)13-5(2)10)4(9)12-8(17)14-6(9)15/h2-4H,1H3,(H3,10,11,13,16)(H2,12,14,15,17);   InChIKey=ICHACPCERMCAMT-UHFFFAOYSA-N;   SMILES=C12C(C3(C1NC(NC3=O)=O)C)C(=NC(N2)=O)N;   cyclobutane-cytosine-thymine;   cytosine-thymine cycloadduct;   cytosine-thymine dimer
 xref: PMID:22817898


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  CHEBI ontology 24485
    role 24397
      biological role 24364
        biochemical role 23779
          metabolite 23702
            prokaryotic metabolite 20890
              bacterial metabolite 20890
                Mycoplasma genitalium metabolite 7828
                  5-amino-4a-methyl-1,2,3,4,4a,4b,7,8,8a,8b-decahydro-1,3,6,8-tetraazabiphenylene-2,4,7-trione 0
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  CHEBI ontology 24485
    subatomic particle 24442
      composite particle 24442
        hadron 24442
          baryon 24442
            nucleon 24442
              atomic nucleus 24442
                atom 24442
                  main group element atom 24300
                    p-block element atom 24300
                      carbon group element atom 24084
                        carbon atom 24047
                          organic molecular entity 24047
                            organic molecule 23929
                              organic cyclic compound 23125
                                organic heterocyclic compound 21324
                                  organic heteropolycyclic compound 20429
                                    organic heterotricyclic compound 15020
                                      cyclobutadipyrimidine 0
                                        5-amino-4a-methyl-1,2,3,4,4a,4b,7,8,8a,8b-decahydro-1,3,6,8-tetraazabiphenylene-2,4,7-trione 0
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