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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-[(2R,3S)-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-2-[[methyl-[(1-naphthalenylamino)-oxomethyl]amino]methyl]-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-8-yl]cyclohexanecarboxamide
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Accession:CHEBI:124791 term browser browse the term
Definition:A naphthalene that has formula C34H42N4O5.
Synonyms:related_synonym: Formula=C34H42N4O5;   InChI=1S/C34H42N4O5/c1-22-19-38(23(2)21-39)33(41)28-18-26(35-32(40)25-11-5-4-6-12-25)16-17-30(28)43-31(22)20-37(3)34(42)36-29-15-9-13-24-10-7-8-14-27(24)29/h7-10,13-18,22-23,25,31,39H,4-6,11-12,19-21H2,1-3H3,(H,35,40)(H,36,42)/t22-,23-,31-/m0/s1;   InChIKey=WTDFUXHNPPZUHK-BVXAZASISA-N;   SMILES=C[C@H]1CN(C(=O)C2=C(C=CC(=C2)NC(=O)C3CCCCC3)O[C@H]1CN(C)C(=O)NC4=CC=CC5=CC=CC=C54)[C@@H](C)CO
 xref: LINCS:LSM-36233


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Term Annotations click to browse term
  CHEBI ontology 501
    chemical entity 501
      molecular entity 501
        polyatomic entity 494
          molecule 473
            cyclic compound 454
              bicyclic compound 48
                carbobicyclic compound 6
                  naphthalenes 5
                    N-[(2R,3S)-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-2-[[methyl-[(1-naphthalenylamino)-oxomethyl]amino]methyl]-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-8-yl]cyclohexanecarboxamide 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
                    p-block element atom 494
                      carbon group element atom 483
                        carbon atom 482
                          organic molecular entity 482
                            organic molecule 471
                              organic cyclic compound 454
                                carbocyclic compound 193
                                  carbopolycyclic compound 11
                                    carbobicyclic compound 6
                                      naphthalenes 5
                                        N-[(2R,3S)-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-2-[[methyl-[(1-naphthalenylamino)-oxomethyl]amino]methyl]-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-8-yl]cyclohexanecarboxamide 0
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