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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 20059
        role 20009
          biological role 20008
            aetiopathogenetic role 19264
              carcinogenic agent 18536
                aflatoxin B1 11099
                  aflatoxin B1 8,9-dihydrodiol 0
                  aflatoxin B1 endo-8,9-oxide 0
                  aflatoxin B1 triol 0
                  aflatoxin M1 + 430
                  aflatoxin Q1 2
    Path 2
    Term Annotations click to browse term
      CHEBI ontology 20059
        subatomic particle 20056
          composite particle 20056
            hadron 20056
              baryon 20056
                nucleon 20056
                  atomic nucleus 20056
                    atom 20056
                      main group element atom 19956
                        p-block element atom 19956
                          carbon group element atom 19882
                            carbon atom 19873
                              organic molecular entity 19873
                                organic molecule 19819
                                  organic cyclic compound 19581
                                    organic heterocyclic compound 18804
                                      organic heteropolycyclic compound 18274
                                        organic heteropentacyclic compound 13411
                                          cyclopentafurofurochromene 11099
                                            aflatoxin 11099
                                              aflatoxin B1 11099
                                                aflatoxin B1 8,9-dihydrodiol 0
                                                aflatoxin B1 endo-8,9-oxide 0
                                                aflatoxin B1 triol 0
                                                aflatoxin M1 + 430
                                                aflatoxin Q1 2
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