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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:aristolochic acid A
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Accession:CHEBI:2825 term browser browse the term
Definition:An aristolochic acid that is phenanthrene-1-carboxylic acid that is substituted by a methylenedioxy group at the 3,4 positions, by a methoxy group at position 8, and by a nitro group at position 10. It is the most abundant of the aristolochic acids and is found in almost all Aristolochia (birthworts or pipevines) species. It has been tried in a number of treatments for inflammatory disorders, mainly in Chinese and folk medicine. However, there is concern over their use as aristolochic acid is both carcinogenic and nephrotoxic.
Synonyms:exact_synonym: 8-methoxy-6-nitro-2H-phenanthro[3,4-d][1,3]dioxole-5-carboxylic acid
 related_synonym: 3,4-methylenedioxy-8-methoxy-10-nitro-1-phenanthrenecarboxylic acid;   8-methoxy-6-nitrophenanthol (3,4-d) 1,3-dioxole-5-carboxylic acid;   8-methoxy-6-nitrophenanthro[3,4-d][1,3]dioxole-5-carboxylic acid;   AAA;   Aristolochic acid;   Aristolochic acid I;   Formula=C17H11NO7;   InChI=1S/C17H11NO7/c1-23-12-4-2-3-8-9(12)5-11(18(21)22)14-10(17(19)20)6-13-16(15(8)14)25-7-24-13/h2-6H,7H2,1H3,(H,19,20);   InChIKey=BBFQZRXNYIEMAW-UHFFFAOYSA-N;   SMILES=COc1cccc2c1cc([N+]([O-])=O)c1c(cc3OCOc3c21)C(O)=O;   aristolochin
 xref: CAS:313-67-7;   KEGG:C08469;   KNApSAcK:C00001526;   KNApSAcK:C00027516;   LINCS:LSM-2373
 xref_mesh: MESH:C000228
 xref: PMID:21558304;   PMID:21719716;   PMID:22071594;   PMID:22118289;   PMID:22126455;   PMID:22245565;   PMID:22373701;   Reaxys:345159;   Wikipedia:Aristolochic_acid


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      CHEBI ontology 22426
        role 22410
          biological role 22409
            biochemical role 21637
              metabolite 21590
                aristolochic acid A 6581
                  aristoloterpenate-I 0
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      CHEBI ontology 22426
        subatomic particle 22420
          composite particle 22420
            hadron 22420
              baryon 22420
                nucleon 22420
                  atomic nucleus 22420
                    atom 22420
                      main group element atom 22307
                        p-block element atom 22307
                          carbon group element atom 22109
                            carbon atom 22042
                              organic molecular entity 22042
                                heteroorganic entity 21689
                                  organochalcogen compound 21185
                                    organooxygen compound 21026
                                      carbon oxoacid 19807
                                        carboxylic acid 19803
                                          monocarboxylic acid 19066
                                            aristolochic acids 6616
                                              aristolochic acid A 6581
                                                aristoloterpenate-I 0
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