Submit Data |  Help |  Video Tutorials |  News |  Publications |  FTP Download |  REST API |  Citing RGD |  Contact   

ONTOLOGY REPORT - ANNOTATIONS


Term:Brevetoxin B1
go back to main search page
Accession:CHEBI:138845 term browser browse the term
Synonyms:related_synonym: Formula=C52H75NO17S;   InChI=1S/C52H75NO17S/c1-26-17-32-37(24-50(6)39(63-32)22-36-46(69-50)27(2)18-44(55)65-36)62-31-11-13-49(5)40(66-45(26)31)23-41-51(7,70-49)25-43-48(4,68-41)12-9-10-30-33(64-43)20-35-34(61-30)21-42-52(8,67-35)38(54)19-29(60-42)16-28(3)47(56)53-14-15-71(57,58)59/h9-10,18,26,29-43,45-46,54H,3,11-17,19-25H2,1-2,4-8H3,(H,53,56)(H,57,58,59)/b10-9-/t26-,29-,30-,31+,32+,33+,34+,35-,36+,37-,38+,39-,40+,41-,42-,43-,45-,46-,48+,49-,50+,51+,52+/m1/s1;   InChIKey=LUNOZQKEODBLAF-BTMAFXPRSA-N;   SMILES=[C@]12([C@](C[C@H]([C@@]3([C@](CC[C@]4(O[C@]5(C[C@]6(O[C@@]7([C@@](C=CC[C@@]6(O[C@@]5(C[C@@]4(O3)[H])[H])C)(O[C@@]8([C@@](C7)(O[C@@]9([C@@](C8)(O[C@@](C[C@@H]9O)(CC(C(NCCS(O)(=O)=O)=O)=C)[H])[H])C)[H])[H])[H])[H])[H])C)C)(O1)[H])[H])C)(O[C@]%10([C@](C2)(O[C@]%11([C@](C%10)(OC(C=C%11C)=O)[H])[H])C)[H])[H])[H]
 xref: KEGG:C20013


show annotations for term's descendants       view all columns           Sort by:
 

Term paths to the root
Path 1
Term Annotations click to browse term
  CHEBI ontology 19764
    role 19711
      biological role 19710
        poison 17960
          toxin 13838
            ciguatoxin 923
              Brevetoxin B1 0
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
                            heteroorganic entity 19106
                              organochalcogen compound 18802
                                organooxygen compound 18713
                                  ether 15852
                                    cyclic ether 6507
                                      polycyclic ether 1306
                                        ciguatoxin 923
                                          Brevetoxin B1 0
paths to the root

NHLBI Logo

RGD is funded by grant HL64541 from the National Heart, Lung, and Blood Institute on behalf of the NIH.