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ONTOLOGY REPORT - ANNOTATIONS


Term:minocycline
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Accession:CHEBI:50694 term browser browse the term
Definition:A tetracycline analogue having a dimethylamino group at position 7 and lacking the methyl and hydroxy groups at position 5.
Synonyms:related_synonym: (4S,4AS,5AR,12AS)-4,7-BIS(DIMETHYLAMINO)-3,10,12,12A-TETRAHYDROXY-1,11-DIOXO-1,4,4A,5,5A,6,11,12A-OCTAHYDROTETRACENE-2-CARBOXAMIDE;   7-Dimethylamino-6-demethyl-6-deoxytetracycline;   Formula=C23H27N3O7;   InChI=1S/C23H27N3O7/c1-25(2)12-5-6-13(27)15-10(12)7-9-8-11-17(26(3)4)19(29)16(22(24)32)21(31)23(11,33)20(30)14(9)18(15)28/h5-6,9,11,17,27,29-30,33H,7-8H2,1-4H3,(H2,24,32)/t9-,11-,17-,23-/m0/s1;   InChIKey=DYKFCLLONBREIL-KVUCHLLUSA-N;   SMILES=[H][C@@]12Cc3c(ccc(O)c3C(=O)C1=C(O)[C@]1(O)C(=O)C(C(N)=O)=C(O)[C@@H](N(C)C)[C@]1([H])C2)N(C)C;   minociclina;   minociclinum;   minomycin
 alt_id: CHEBI:44053;   CHEBI:6939
 xref: Beilstein:3077644 "Beilstein";   CAS:10118-90-8 "ChemIDplus";   CAS:10118-90-8 "KEGG COMPOUND";   DrugBank:DB01017;   Drug_Central:1813 "DrugCentral";   HMDB:HMDB0015152;   KEGG:C07225;   KEGG:D05045;   KNApSAcK:C00018686;   LIPID_MAPS_instance:LMPK07000002 "LIPID MAPS"
 xref_mesh: MESH:D008911
 xref: PDBeChem:MIY;   PMID:28709717 "Europe PMC";   PMID:31630007 "Europe PMC";   PMID:31719236 "Europe PMC";   PMID:31733348 "Europe PMC";   Patent:US3226436;   Patent:WO2008104734;   Reaxys:3077644 "Reaxys"
 cyclic_relationship: is_conjugate_acid_of CHEBI:71337;   is_tautomer_of CHEBI:77906


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Term Annotations click to browse term
  CHEBI ontology 0
    role 0
      biological role 0
        antimicrobial agent 0
          tetracenomycin 0
            minocycline 0
              minocycline hydrochloride 0
Path 2
Term Annotations click to browse term
  CHEBI ontology 0
    subatomic particle 0
      composite particle 0
        hadron 0
          baryon 0
            nucleon 0
              atomic nucleus 0
                atom 0
                  main group element atom 0
                    p-block element atom 0
                      carbon group element atom 0
                        carbon atom 0
                          organic molecular entity 0
                            organic group 0
                              organic divalent group 0
                                organodiyl group 0
                                  carbonyl group 0
                                    carbonyl compound 0
                                      ketone 0
                                        oxyketone 0
                                          alpha-oxyketone 0
                                            alpha-hydroxy ketone 0
                                              tertiary alpha-hydroxy ketone 0
                                                minocycline 0
                                                  minocycline hydrochloride 0
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