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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:blasticidin S(1+)
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Accession:CHEBI:57289 term browser browse the term
Definition:A guanidinium ion that is the conjugate acid of blasticidin S.
Synonyms:exact_synonym: 4-amino-1-(4-{[(3S)-3-ammonio-5-{[ammonio(imino)methyl](methyl)amino}pentanoyl]amino}-2,3,4-trideoxy-beta-D-erythro-hex-2-enopyranosyluronosyl)pyrimidin-2(1H)-one
 related_synonym: Formula=C17H27N8O5;   InChI=1S/C17H26N8O5/c1-24(16(20)21)6-4-9(18)8-12(26)22-10-2-3-13(30-14(10)15(27)28)25-7-5-11(19)23-17(25)29/h2-3,5,7,9-10,13-14H,4,6,8,18H2,1H3,(H3,20,21)(H,22,26)(H,27,28)(H2,19,23,29)/p+1/t9?,10-,13+,14-/m0/s1;   InChIKey=CXNPLSGKWMLZPZ-ZNIXKSQXSA-O;   SMILES=CN(CC[C@H]([NH3+])CC(=O)N[C@H]1C=C[C@@H](O[C@@H]1C([O-])=O)n1ccc(N)nc1=O)C(N)=[NH2+];   blasticidin S
 xref: MetaCyc:BLASTICIDIN-S
 cyclic_relationship: is_conjugate_acid_of CHEBI:15353



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  CHEBI ontology 20059
    role 20009
      biological role 20008
        antimicrobial agent 17758
          antifungal agent 15844
            antibiotic antifungal agent 6007
              blasticidin S(1+) 0
Path 2
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  CHEBI ontology 20059
    subatomic particle 20056
      composite particle 20056
        hadron 20056
          baryon 20056
            nucleon 20056
              atomic nucleus 20056
                atom 20056
                  main group element atom 19956
                    p-block element atom 19956
                      carbon group element atom 19882
                        carbon atom 19873
                          organic molecular entity 19873
                            organic ion 9180
                              organic cation 8121
                                iminium ion 87
                                  guanidinium ion 0
                                    blasticidin S(1+) 0
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