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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:bastadin 5
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Accession:CHEBI:68323 term browser browse the term
Definition:A macrocyclic lactam isolated from the marine sponge Ianthella and has been shown to exhibit calcium channel modulatory activity.
Synonyms:exact_synonym: (12E,25E)-4,16,21,31,36-pentabromo-17,32-dihydroxy-12,25-bis(hydroxyimino)-2,19-dioxa-10,27-diazapentacyclo[28.2.2.2(20,23).1(3,7).1(14,18)]octatriaconta-1(32),3(38),4,6,14(37),15,17,20,22,30,33,35-dodecaene-11,26-dione
 related_synonym: 2,18-Dioxa-10,27-diazapentacyclo(28.2.2.2(14,17).1(3,7).1(19,23))octatriaconta-3,5,7(38),14,16,19,21,23(35),30,32,33,36-dodecaene-11,12,25,26-tetrone, 5,16,21,32,36-pentabromo-4,20-dihydroxy-, 12,25-dioxime;   Formula=C34H27Br5N4O8;   InChI=1S/C34H27Br5N4O8/c35-20-3-1-16-5-7-40-33(46)25(43-49)13-18-9-21(36)30(44)28(15-18)51-32-22(37)10-17(11-23(32)38)12-24(42-48)34(47)41-8-6-19-2-4-26(31(45)29(19)39)50-27(20)14-16/h1-4,9-11,14-15,44-45,48-49H,5-8,12-13H2,(H,40,46)(H,41,47)/b42-24+,43-25+;   InChIKey=RINLQEBBENMFQH-FFVIWPAXSA-N;   SMILES=O\\N=C1/Cc2cc(Br)c(Oc3cc(C\\C(C(=O)NCCc4ccc(Br)c(Oc5ccc(CCNC1=O)c(Br)c5O)c4)=N/O)cc(Br)c3O)c(Br)c2
 xref: CAS:79067-75-7;   PMID:21214221;   Reaxys:4226459


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Term Annotations click to browse term
  CHEBI ontology 26504
    role 26326
      biological role 26305
        biochemical role 25518
          metabolite 25454
            bastadin 5 0
Path 2
Term Annotations click to browse term
  CHEBI ontology 26504
    subatomic particle 26480
      composite particle 26480
        hadron 26480
          baryon 26480
            nucleon 26480
              atomic nucleus 26480
                atom 26480
                  main group element atom 26217
                    p-block element atom 26217
                      carbon group element atom 25662
                        carbon atom 25624
                          organic molecular entity 25624
                            heteroorganic entity 25007
                              organochalcogen compound 24601
                                organooxygen compound 24195
                                  carbon oxoacid 22810
                                    carboxylic acid 22790
                                      carboacyl group 20091
                                        univalent carboacyl group 20091
                                          carbamoyl group 19616
                                            carboxamide 19616
                                              lactam 8858
                                                bastadin 5 0
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