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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:(6S,7R,8R)-N-(4-fluorophenyl)-8-(hydroxymethyl)-2-oxo-7-[4-[2-(3-pyridinyl)ethynyl]phenyl]-1,4-diazabicyclo[4.2.0]octane-4-carboxamide
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Accession:CHEBI:127485 term browser browse the term
Definition:An azetidine that has formula C27H23FN4O3.
Synonyms:related_synonym: Formula=C27H23FN4O3;   InChI=1S/C27H23FN4O3/c28-21-9-11-22(12-10-21)30-27(35)31-15-23-26(24(17-33)32(23)25(34)16-31)20-7-5-18(6-8-20)3-4-19-2-1-13-29-14-19/h1-2,5-14,23-24,26,33H,15-17H2,(H,30,35)/t23-,24+,26-/m1/s1;   InChIKey=RFRREKCMRAAOSC-RMTZWNOUSA-N;   SMILES=C1[C@@H]2[C@H]([C@@H](N2C(=O)CN1C(=O)NC3=CC=C(C=C3)F)CO)C4=CC=C(C=C4)C#CC5=CN=CC=C5
 xref: LINCS:LSM-39043



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  CHEBI ontology 503
    chemical entity 503
      molecular entity 503
        polyatomic entity 496
          molecule 475
            cyclic compound 456
              ring assembly 3
                (6S,7R,8R)-N-(4-fluorophenyl)-8-(hydroxymethyl)-2-oxo-7-[4-[2-(3-pyridinyl)ethynyl]phenyl]-1,4-diazabicyclo[4.2.0]octane-4-carboxamide 0
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Term Annotations click to browse term
  CHEBI ontology 503
    subatomic particle 503
      composite particle 503
        hadron 503
          baryon 503
            nucleon 503
              atomic nucleus 503
                atom 503
                  main group element atom 496
                    p-block element atom 496
                      carbon group element atom 485
                        carbon atom 484
                          organic molecular entity 484
                            organic molecule 473
                              organic cyclic compound 456
                                carbocyclic compound 194
                                  benzenoid aromatic compound 192
                                    benzenes 186
                                      (6S,7R,8R)-N-(4-fluorophenyl)-8-(hydroxymethyl)-2-oxo-7-[4-[2-(3-pyridinyl)ethynyl]phenyl]-1,4-diazabicyclo[4.2.0]octane-4-carboxamide 0
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