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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:(2R,3R)-10-amino-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-2-(methylaminomethyl)-3,4-dihydro-2H-1,5-benzoxazocin-6-one
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Accession:CHEBI:113659 term browser browse the term
Definition:An aromatic ether that has formula C16H25N3O3.
Synonyms:related_synonym: Formula=C16H25N3O3;   InChI=1S/C16H25N3O3/c1-10-8-19(11(2)9-20)16(21)12-5-4-6-13(17)15(12)22-14(10)7-18-3/h4-6,10-11,14,18,20H,7-9,17H2,1-3H3/t10-,11-,14+/m1/s1;   InChIKey=CZXYLKJVFUIZEK-GYSYKLTISA-N;   SMILES=C[C@@H]1CN(C(=O)C2=C(C(=CC=C2)N)O[C@H]1CNC)[C@H](C)CO
 xref: LINCS:LSM-25091


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Term Annotations click to browse term
  CHEBI ontology 501
    chemical entity 501
      group 495
        polyatomic entity 494
          molecule 473
            organic molecule 471
              organic cyclic compound 454
                organic aromatic compound 393
                  aromatic ether 57
                    (2R,3R)-10-amino-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-2-(methylaminomethyl)-3,4-dihydro-2H-1,5-benzoxazocin-6-one 0
Path 2
Term Annotations click to browse term
  CHEBI ontology 501
    subatomic particle 501
      composite particle 501
        hadron 501
          baryon 501
            nucleon 501
              atomic nucleus 501
                atom 501
                  main group element atom 494
                    main group molecular entity 494
                      p-block molecular entity 494
                        carbon group molecular entity 483
                          organic molecular entity 482
                            heteroorganic entity 476
                              organochalcogen compound 430
                                organooxygen compound 428
                                  ether 59
                                    aromatic ether 57
                                      (2R,3R)-10-amino-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-2-(methylaminomethyl)-3,4-dihydro-2H-1,5-benzoxazocin-6-one 0
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