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Term:bryotoxin A
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Accession:CHEBI:3201 term browser browse the term
Definition:A bufadienolide glycoside that is 3,5,11,14-tetrahydroxy-12,19-dioxobufa-20,22-dienolide attached to a 3-O-acetyl-4,6-dideoxy-beta-D-arabino-hexopyranosyl residue at position 3 via a glycosidic linkage.
Synonyms:exact_synonym: (3beta,5beta,11alpha)-3-[(3-O-acetyl-4,6-dideoxy-beta-D-arabino-hexopyranosyl)oxy]-5,11,14-trihydroxy-12,19-dioxobufa-20,22-dienolide
 related_synonym: Formula=C32H42O12;   InChI=1S/C32H42O12/c1-16-12-22(43-17(2)34)25(36)28(42-16)44-19-6-9-30(15-33)24-21(7-10-31(30,39)13-19)32(40)11-8-20(18-4-5-23(35)41-14-18)29(32,3)27(38)26(24)37/h4-5,14-16,19-22,24-26,28,36-37,39-40H,6-13H2,1-3H3/t16-,19+,20-,21-,22-,24-,25+,26+,28+,29+,30+,31+,32+/m1/s1;   InChIKey=KWKQJZASURFCDP-ZPARAVGQSA-N;   SMILES=C[C@@H]1C[C@@H](OC(C)=O)[C@H](O)[C@H](O[C@H]2CC[C@]3(C=O)[C@H]4[C@H](O)C(=O)[C@]5(C)[C@H](CC[C@]5(O)[C@@H]4CC[C@]3(O)C2)c2ccc(=O)oc2)O1
 xref: CAS:101329-50-4 "ChemIDplus";   CAS:101329-50-4 "KEGG COMPOUND";   KEGG:C08853;   KNApSAcK:C00003607;   PMID:3439945 "Europe PMC";   Reaxys:7108097 "Reaxys"

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Term Annotations click to browse term
  CHEBI ontology 19754
    role 19701
      biological role 19700
        biochemical role 19201
          metabolite 19174
            eukaryotic metabolite 18802
              plant metabolite 17282
                bryotoxin A 0
Path 2
Term Annotations click to browse term
  CHEBI ontology 19754
    subatomic particle 19752
      composite particle 19752
        hadron 19752
          baryon 19752
            nucleon 19752
              atomic nucleus 19752
                atom 19752
                  main group element atom 19637
                    p-block element atom 19637
                      carbon group element atom 19528
                        carbon atom 19517
                          organic molecular entity 19517
                            organic group 18422
                              organic divalent group 18414
                                organodiyl group 18414
                                  carbonyl group 18303
                                    carbonyl compound 18303
                                      carboxylic acid 17971
                                        carboacyl group 17091
                                          univalent carboacyl group 17091
                                            formyl group 7827
                                              aldehyde 7827
                                                steroid aldehyde 86
                                                  bryotoxin A 0
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RGD is funded by grant HL64541 from the National Heart, Lung, and Blood Institute on behalf of the NIH.