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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:tirilazad
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Accession:CHEBI:135853 term browser browse the term
Synonyms:related_synonym: Formula=C38H52N6O2;   InChI=1S/C38H52N6O2/c1-26-22-31-29-9-8-27-23-28(45)10-12-37(27,2)30(29)11-13-38(31,3)35(26)32(46)25-41-18-20-43(21-19-41)34-24-33(42-14-4-5-15-42)39-36(40-34)44-16-6-7-17-44/h10-12,23-24,26,29,31,35H,4-9,13-22,25H2,1-3H3/t26-,29-,31+,35-,37+,38+/m1/s1;   InChIKey=RBKASMJPSJDQKY-RBFSKHHSSA-N;   SMILES=C[C@@]12[C@]([C@]3(C(=CC1)[C@]4(C)C(CC3)=CC(C=C4)=O)[H])(C[C@H]([C@@H]2C(CN5CCN(CC5)C=6C=C(N=C(N6)N7CCCC7)N8CCCC8)=O)C)[H];   freedox;   tirilazad mesilate;   tirilazad mesylate
 xref: CAS:110101-66-1;   Drug_Central:4063


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Path 1
Term Annotations click to browse term
  CHEBI ontology 5164
    role 5131
      biological role 5131
        molecular messenger 467
          hormone 416
            steroid hormone 46
              corticosteroid hormone 27
                tirilazad 0
Path 2
Term Annotations click to browse term
  CHEBI ontology 5164
    subatomic particle 5155
      composite particle 5155
        hadron 5155
          baryon 5155
            nucleon 5155
              atomic nucleus 5155
                atom 5155
                  main group element atom 5127
                    p-block element atom 5124
                      carbon group element atom 5042
                        carbon atom 5041
                          organic molecular entity 5041
                            organic molecule 4990
                              organic cyclic compound 4931
                                organic polycyclic compound 194
                                  steroid 110
                                    steroid hormone 46
                                      corticosteroid hormone 27
                                        tirilazad 0
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