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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:3-cyclohexyl-1-[[(2S,3S)-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-8-[[(1-naphthalenylamino)-oxomethyl]amino]-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-2-yl]methyl]-1-methylurea
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Accession:CHEBI:113594 term browser browse the term
Definition:A naphthalene that has formula C34H43N5O5.
Synonyms:related_synonym: Formula=C34H43N5O5;   InChI=1S/C34H43N5O5/c1-22-19-39(23(2)21-40)32(41)28-18-26(35-33(42)37-29-15-9-11-24-10-7-8-14-27(24)29)16-17-30(28)44-31(22)20-38(3)34(43)36-25-12-5-4-6-13-25/h7-11,14-18,22-23,25,31,40H,4-6,12-13,19-21H2,1-3H3,(H,36,43)(H2,35,37,42)/t22-,23+,31+/m0/s1;   InChIKey=QXYCJPXUIIEYFH-INEJIFKHSA-N;   SMILES=C[C@H]1CN(C(=O)C2=C(C=CC(=C2)NC(=O)NC3=CC=CC4=CC=CC=C43)O[C@@H]1CN(C)C(=O)NC5CCCCC5)[C@H](C)CO
 xref: LINCS:LSM-25026


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Term Annotations click to browse term
  CHEBI ontology 19811
    chemical entity 19840
      molecular entity 19809
        polyatomic entity 19767
          molecule 19702
            cyclic compound 19489
              bicyclic compound 17275
                carbobicyclic compound 5871
                  naphthalenes 3847
                    3-cyclohexyl-1-[[(2S,3S)-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-8-[[(1-naphthalenylamino)-oxomethyl]amino]-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-2-yl]methyl]-1-methylurea 0
Path 2
Term Annotations click to browse term
  CHEBI ontology 19811
    subatomic particle 19809
      composite particle 19809
        hadron 19840
          baryon 19809
            nucleon 19809
              atomic nucleus 19809
                atom 19809
                  main group element atom 19759
                    p-block element atom 19759
                      carbon group element atom 19708
                        carbon atom 19734
                          organic molecular entity 19705
                            organic molecule 19658
                              organic cyclic compound 19471
                                carbocyclic compound 18563
                                  carbopolycyclic compound 17167
                                    carbobicyclic compound 5871
                                      naphthalenes 3847
                                        3-cyclohexyl-1-[[(2S,3S)-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-8-[[(1-naphthalenylamino)-oxomethyl]amino]-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-2-yl]methyl]-1-methylurea 0
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