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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:N-[[(2S,3S)-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-8-pent-1-ynyl-3,4-dihydro-2H-pyrido[2,3-b][1,5]oxazocin-2-yl]methyl]-N,1-dimethyl-4-imidazolesulfonamide
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Accession:CHEBI:106338 term browser browse the term
Definition:An aromatic ether that has formula C24H33N5O5S.
Synonyms:related_synonym: Formula=C24H33N5O5S;   InChI=1S/C24H33N5O5S/c1-6-7-8-9-19-10-20-23(25-11-19)34-21(17(2)12-29(24(20)31)18(3)15-30)13-28(5)35(32,33)22-14-27(4)16-26-22/h10-11,14,16-18,21,30H,6-7,12-13,15H2,1-5H3/t17-,18+,21+/m0/s1;   InChIKey=YVOLCZAPMPCUFP-WAOWUJCRSA-N;   SMILES=CCCC#CC1=CC2=C(N=C1)O[C@@H]([C@H](CN(C2=O)[C@H](C)CO)C)CN(C)S(=O)(=O)C3=CN(C=N3)C
 xref: LINCS:LSM-17698


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Term Annotations click to browse term
  CHEBI ontology 19831
    chemical entity 19829
      group 19788
        polyatomic entity 19787
          molecule 19692
            organic molecule 19677
              organic cyclic compound 19490
                organic aromatic compound 19359
                  aromatic ether 16523
                    N-[[(2S,3S)-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-8-pent-1-ynyl-3,4-dihydro-2H-pyrido[2,3-b][1,5]oxazocin-2-yl]methyl]-N,1-dimethyl-4-imidazolesulfonamide 0
Path 2
Term Annotations click to browse term
  CHEBI ontology 19831
    subatomic particle 19829
      composite particle 19829
        hadron 19829
          baryon 19829
            nucleon 19829
              atomic nucleus 19829
                atom 19829
                  main group element atom 19779
                    main group molecular entity 19779
                      p-block molecular entity 19779
                        carbon group molecular entity 19728
                          organic molecular entity 19724
                            heteroorganic entity 19477
                              organochalcogen compound 19240
                                organooxygen compound 19155
                                  ether 17277
                                    aromatic ether 16523
                                      N-[[(2S,3S)-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-8-pent-1-ynyl-3,4-dihydro-2H-pyrido[2,3-b][1,5]oxazocin-2-yl]methyl]-N,1-dimethyl-4-imidazolesulfonamide 0
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