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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:tak-475
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Accession:CHEBI:229906 term browser browse the term
Synonyms:exact_synonym: 2-[1-[2-[(3R,5S)-1-(3-acetyloxy-2,2-dimethylpropyl)-7-chloro-5-(2,3-dimethoxyphenyl)-2-oxo-5H-4,1-benzoxazepin-3-yl]acetyl]piperidin-4-yl]acetic acid
 related_synonym: Formula=C33H41ClN2O9;   InChI=1S/C33H41ClN2O9/c1-20(37)44-19-33(2,3)18-36-25-10-9-22(34)16-24(25)30(23-7-6-8-26(42-4)31(23)43-5)45-27(32(36)41)17-28(38)35-13-11-21(12-14-35)15-29(39)40/h6-10,16,21,27,30H,11-15,17-19H2,1-5H3,(H,39,40)/t27-,30-/m1/s1;   InChIKey=CMLUGNQVANVZHY-POURPWNDSA-N;   SMILES=ClC1=CC=2[C@H](O[C@H](CC(=O)N3CCC(CC3)CC(O)=O)C(=O)N(CC(COC(=O)C)(C)C)C2C=C1)C4=C(OC)C(OC)=CC=C4
 xref: Chemspider:8049937;   KEGG:D06609


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Path 1
Term Annotations click to browse term
  CHEBI ontology 499
    chemical entity 499
      atom 499
        nonmetal atom 492
          nitrogen atom 416
            nitrogen molecular entity 416
              organonitrogen compound 409
                organonitrogen heterocyclic compound 374
                  tak-475 0
Path 2
Term Annotations click to browse term
  CHEBI ontology 499
    subatomic particle 499
      composite particle 499
        hadron 499
          baryon 499
            nucleon 499
              atomic nucleus 499
                atom 499
                  main group element atom 492
                    main group molecular entity 492
                      p-block molecular entity 492
                        carbon group molecular entity 481
                          organic molecular entity 480
                            organic molecule 471
                              organic cyclic compound 454
                                organic heterocyclic compound 417
                                  organonitrogen heterocyclic compound 374
                                    tak-475 0
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