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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:aflatoxin B1
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Accession:CHEBI:2504 term browser browse the term
Definition:An aflatoxin having a tetrahydrocyclopenta[c]furo[3',2':4,5]furo[2,3-h]chromene skeleton with oxygen functionality at positions 1, 4 and 11.
Synonyms:exact_synonym: (6aR,9aS)-4-methoxy-2,3,6a,9a-tetrahydrocyclopenta[c]furo[3',2':4,5]furo[2,3-h]chromene-1,11-dione
 related_synonym: 2,3,6aalpha,9aalpha-Tetrahydro-4-methoxycyclopenta(c)furo(3',2':4,5)furo(2,3-h)(1)benzopyran-1,11-dione;   Formula=C17H12O6;   InChI=1S/C17H12O6/c1-20-10-6-11-14(8-4-5-21-17(8)22-11)15-13(10)7-2-3-9(18)12(7)16(19)23-15/h4-6,8,17H,2-3H2,1H3/t8-,17+/m0/s1;   InChIKey=OQIQSTLJSLGHID-WNWIJWBNSA-N;   SMILES=[H][C@]12OC=C[C@@]1([H])c1c(O2)cc(OC)c2c3CCC(=O)c3c(=O)oc12
 xref: CAS:1162-65-8;   KEGG:C06800;   KNApSAcK:C00000546
 xref_mesh: MESH:D016604


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Term paths to the root
Path 1
Term Annotations click to browse term
  CHEBI ontology 19791
    role 19738
      biological role 19738
        aetiopathogenetic role 18935
          carcinogenic agent 18308
            aflatoxin B1 10842
              aflatoxin B1 8,9-dihydrodiol 0
              aflatoxin B1 endo-8,9-oxide 0
              aflatoxin B1 triol 0
              aflatoxin M1 + 424
              aflatoxin Q1 1
Path 2
Term Annotations click to browse term
  CHEBI ontology 19791
    subatomic particle 19788
      composite particle 19788
        hadron 19788
          baryon 19788
            nucleon 19788
              atomic nucleus 19788
                atom 19788
                  main group element atom 19676
                    p-block element atom 19676
                      carbon group element atom 19579
                        carbon atom 19568
                          organic molecular entity 19568
                            organic molecule 19493
                              organic cyclic compound 19288
                                organic heterocyclic compound 18407
                                  organic heteropolycyclic compound 17819
                                    organic heteropentacyclic compound 13218
                                      cyclopentafurofurochromene 11283
                                        aflatoxin 11283
                                          aflatoxin B1 10842
                                            aflatoxin B1 8,9-dihydrodiol 0
                                            aflatoxin B1 endo-8,9-oxide 0
                                            aflatoxin B1 triol 0
                                            aflatoxin M1 + 424
                                            aflatoxin Q1 1
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