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ONTOLOGY REPORT - ANNOTATIONS


Term:phakellistatin 14
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Accession:CHEBI:66742 term browser browse the term
Definition:A homodetic cyclic peptide isolated from a marine sponge Phakellia sp. It exhibits cytotoxic activity against murine P388 lymphocytic leukemia cells and moderate cancer cell growth inhibitory activity against a panel of human cancer cells.
Synonyms:exact_synonym: methyl {(3S,6S,9S,12S,15S,18S,23aS)-3-benzyl-18-[(2S)-butan-2-yl]-9,15-dimethyl-12-[2-(methylsulfinyl)ethyl]-1,4,7,10,13,16,19-heptaoxodocosahydro-1H-pyrrolo[1,2-a][1,4,7,10,13,16,19]heptaazacyclohenicosin-6-yl}acetate
 related_synonym: Formula=C36H53N7O10S;   InChI=1S/C36H53N7O10S/c1-7-20(2)29-36(51)43-16-11-14-27(43)35(50)41-25(18-23-12-9-8-10-13-23)34(49)40-26(19-28(44)53-5)33(48)38-21(3)30(45)39-24(15-17-54(6)52)32(47)37-22(4)31(46)42-29/h8-10,12-13,20-22,24-27,29H,7,11,14-19H2,1-6H3,(H,37,47)(H,38,48)(H,39,45)(H,40,49)(H,41,50)(H,42,46)/t20-,21-,22-,24-,25-,26-,27-,29-,54?/m0/s1;   InChIKey=ZBIJFJOAXJXGTR-KLZQDHKKSA-N;   SMILES=CC[C@H](C)[C@@H]1NC(=O)[C@H](C)NC(=O)[C@H](CCS(C)=O)NC(=O)[C@H](C)NC(=O)[C@H](CC(=O)OC)NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@@H]2CCCN2C1=O
 xref: Chemspider:10480460;   PMID:15679318 "Europe PMC";   Reaxys:10232750 "Reaxys"


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  CHEBI ontology 828
    role 805
      biological role 805
        biochemical role 678
          metabolite 662
            phakellistatin 14 0
Path 2
Term Annotations click to browse term
  CHEBI ontology 828
    subatomic particle 812
      composite particle 812
        hadron 812
          baryon 812
            nucleon 812
              atomic nucleus 812
                atom 812
                  main group element atom 800
                    p-block element atom 797
                      carbon group element atom 769
                        carbon atom 765
                          organic molecular entity 765
                            organic group 354
                              organic divalent group 352
                                organodiyl group 352
                                  carbonyl group 351
                                    carbonyl compound 351
                                      carboxylic acid 237
                                        carboacyl group 154
                                          univalent carboacyl group 154
                                            carbamoyl group 151
                                              carboxamide 151
                                                peptide 36
                                                  cyclic peptide 17
                                                    homodetic cyclic peptide 10
                                                      phakellistatin 14 0
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RGD is funded by grant HL64541 from the National Heart, Lung, and Blood Institute on behalf of the NIH.