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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:cleistanthin A
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Accession:CHEBI:3737 term browser browse the term
Definition:A member of the class of cleistanthins that is the 4-O-3,4-di-O-methyl-beta-D-xylopyranoside of 1,3-dihydronaphtho[2,3-c]furan-4-ol which is substituted by an oxo group at position 1, methoxy groups at positions 6 and 7, and a 1,3-benzodioxol-5-yl group at position 9. It is one of the toxic principles in Cleistanthus collinus.
Synonyms:exact_synonym: 9-(1,3-benzodioxol-5-yl)-6,7-dimethoxy-1-oxo-1,3-dihydronaphtho[2,3-c]furan-4-yl 3,4-di-O-methyl-beta-D-xylopyranoside
 related_synonym: Ciba Go. 4350;   Formula=C28H28O11;   InChI=1S/C28H28O11/c1-31-18-8-14-15(9-19(18)32-2)25(39-28-24(29)26(34-4)21(33-3)11-36-28)16-10-35-27(30)23(16)22(14)13-5-6-17-20(7-13)38-12-37-17/h5-9,21,24,26,28-29H,10-12H2,1-4H3/t21-,24-,26+,28?/m1/s1;   InChIKey=FCOQWUOWHWHTJP-DZXBDMBVSA-N;   SMILES=CO[C@@H]1CO[C@@H](Oc2c3COC(=O)c3c(-c3ccc4OCOc4c3)c3cc(OC)c(OC)cc23)[C@H](O)[C@H]1OC;   cleistanthin
 xref: CAS:25047-48-7;   KEGG:C10548;   KNApSAcK:C00002590;   PMID:10608617;   PMID:10648905;   PMID:14600376;   PMID:1506455;   PMID:16450297;   PMID:17212028;   PMID:17404921;   PMID:21969796;   PMID:22351983;   PMID:22471465;   PMID:22529475;   PMID:22701286;   PMID:22754257;   PMID:22787347;   PMID:24929344;   PMID:25040437;   PMID:25298685;   PMID:25316991;   PMID:5109270;   PMID:5498901;   PMID:6471818;   Patent:EP2393779;   Patent:US2012029179;   Reaxys:5194207


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Term Annotations click to browse term
  CHEBI ontology 19831
    role 19807
      application 19650
        pharmaceutical 19491
          drug 19491
            diuretic 4109
              cleistanthin A 0
Path 2
Term Annotations click to browse term
  CHEBI ontology 19831
    subatomic particle 19829
      composite particle 19829
        hadron 19829
          baryon 19829
            nucleon 19829
              atomic nucleus 19829
                atom 19829
                  main group element atom 19779
                    p-block element atom 19779
                      carbon group element atom 19728
                        carbon atom 19724
                          organic molecular entity 19724
                            heteroorganic entity 19477
                              organochalcogen compound 19240
                                organooxygen compound 19155
                                  carbohydrates and carbohydrate derivatives 15289
                                    carbohydrate 15289
                                      monosaccharide 4805
                                        aldose 3222
                                          aldopentose 762
                                            xylose 2
                                              xylose derivative 0
                                                cleistanthin A 0
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