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ONTOLOGY REPORT - ANNOTATIONS


Term:Ingenol 3,20-dibenzoate
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Accession:CHEBI:5923 term browser browse the term
Definition:A benzoate ester that has formula C34H36O7.
Synonyms:related_synonym: Formula=C34H36O7;   InChI=1S/C34H36O7/c1-19-17-33-20(2)15-25-26(32(25,3)4)24(28(33)36)16-23(18-40-30(37)21-11-7-5-8-12-21)27(35)34(33,39)29(19)41-31(38)22-13-9-6-10-14-22/h5-14,16-17,20,24-27,29,35,39H,15,18H2,1-4H3/t20-,24+,25-,26+,27-,29+,33+,34+/m1/s1;   InChIKey=GIMKEHNOTHXONN-NXBFFCPZSA-N;   SMILES=C[C@@H]1C[C@@H]2[C@H]([C@@H]3C=C(COC(=O)c4ccccc4)[C@@H](O)[C@]4(O)[C@@H](OC(=O)c5ccccc5)C(C)=C[C@@]14C3=O)C2(C)C
 xref: CAS:59086-90-7 "KEGG COMPOUND";   KEGG:C09113;   KNApSAcK:C00003440
 xref_mesh: MESH:C011875


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Ingenol 3,20-dibenzoate term browser
Symbol Object Name JBrowse Chr Start Stop Reference
G Pparg peroxisome proliferator-activated receptor gamma JBrowse link 4 147,274,055 147,399,383 RGD:6480464
G Prkd1 protein kinase D1 JBrowse link 6 71,035,017 71,349,531 RGD:6480464

Term paths to the root
Path 1
Term Annotations click to browse term
  CHEBI ontology 19764
    chemical entity 19763
      group 19672
        inorganic group 19144
          oxo group 18311
            organic oxo compound 18311
              carbonyl compound 18311
                carboxylic ester 13989
                  benzoate ester 4002
                    Ingenol 3,20-dibenzoate 2
Path 2
Term Annotations click to browse term
  CHEBI ontology 19764
    subatomic particle 19762
      composite particle 19762
        hadron 19762
          baryon 19762
            nucleon 19762
              atomic nucleus 19762
                atom 19762
                  main group element atom 19646
                    p-block element atom 19646
                      carbon group element atom 19540
                        carbon atom 19529
                          organic molecular entity 19529
                            organic group 18432
                              organic divalent group 18423
                                organodiyl group 18423
                                  carbonyl group 18311
                                    carbonyl compound 18311
                                      carboxylic acid 17976
                                        aromatic carboxylic acid 10743
                                          benzoic acids 10709
                                            benzoate ester 4002
                                              Ingenol 3,20-dibenzoate 2
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