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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:anisatin
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Accession:CHEBI:182764 term browser browse the term
Definition:A sesquiterpene lactone with formula C15H20O8. It is a neurotoxic natural product found in plants of the family Illiciaceae.
Synonyms:exact_synonym: (1R,3'S,4R,5R,6aR,7R,9R,9aS)-1,5,6a,7-tetrahydroxy-5,9-dimethylhexahydrospiro[4,9a-methanocyclopenta[d]oxocine-6,3'-oxetane]-2,2'(1H)-dione
 related_synonym: (1R,3'S,4R,5R,6aR,7R,9R,9aS)-hexahydro-1,5,6a,7-tetrahydroxy-5,9-dimethylspiro[4H-4,9a-methanocyclopent[d]oxocin-6(2H),3'-oxetane]-2,2'-dione;   Formula=C15H20O8;   InChI=1S/C15H20O8/c1-6-3-7(16)15(21)13(6)4-8(23-10(18)9(13)17)12(2,20)14(15)5-22-11(14)19/h6-9,16-17,20-21H,3-5H2,1-2H3/t6-,7-,8+,9+,12+,13+,14+,15-/m1/s1;   InChIKey=GEVWHIDSUOMVRI-QWNPAUMXSA-N;   SMILES=C[C@@H]1C[C@@H](O)[C@]2(O)[C@]3(COC3=O)[C@@](C)(O)[C@H]3C[C@@]12[C@@H](O)C(=O)O3
 alt_id: CHEBI:2733
 xref: CAS:5230-87-5;   FooDB:FDB005800;   HMDB:HMDB0302686;   KEGG:C09294;   KNApSAcK:C00003212;   PMID:10413298;   PMID:10434749;   PMID:10455311;   PMID:11430054;   PMID:18670129;   PMID:19159273;   PMID:22369157;   PMID:22484123;   PMID:23802692;   PMID:23932223;   PMID:25133938;   PMID:26361344;   PMID:33426076;   PMID:37467672;   PMID:6292798;   PMID:6307484;   PMID:6974321;   PMID:7284788;   Wikipedia:Anisatin


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Path 1
Term Annotations click to browse term
  CHEBI ontology 19915
    role 19885
      biological role 19883
        aetiopathogenetic role 19251
          neurotoxin 18220
            anisatin 0
Path 2
Term Annotations click to browse term
  CHEBI ontology 19915
    subatomic particle 19913
      composite particle 19895
        hadron 19895
          baryon 19913
            nucleon 19895
              atomic nucleus 19913
                atom 19895
                  main group element atom 19852
                    p-block element atom 19834
                      carbon group element atom 19774
                        carbon atom 19770
                          organic molecular entity 19770
                            heteroorganic entity 19542
                              organochalcogen compound 19302
                                organooxygen compound 19218
                                  ester 17459
                                    carboxylic ester 16772
                                      lactone 13290
                                        terpene lactone 2187
                                          sesquiterpene lactone 2043
                                            anisatin 0
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