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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:9-(2-carboxyethyl)-10-methylanthracene endoperoxide
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Accession:CHEBI:44592 term browser browse the term
Definition:A peroxide-bridged anthracene substituted at the bridgeheads with methyl and carboxyethyl groups.
Synonyms:exact_synonym: 3-(10-methyl-9,10-epidioxyanthracen-9(10H)-yl)propanoic acid
 related_synonym: Formula=C18H16O4;   InChI=1S/C18H16O4/c1-17-12-6-2-4-8-14(12)18(22-21-17,11-10-16(19)20)15-9-5-3-7-13(15)17/h2-9H,10-11H2,1H3,(H,19,20)/t17-,18+;   InChIKey=IOWYALZFEJOVHO-HDICACEKSA-N;   SMILES=C[C@@]12OO[C@@](CCC(O)=O)(c3ccccc13)c1ccccc21;   [2'-CARBOXYLETHYL]-10-METHYL-ANTHRACENE ENDOPEROXIDE
 xref: PDB:1LO2;   PDBeChem:OX1;   PMID:12093912

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          9-(2-carboxyethyl)-10-methylanthracene endoperoxide 0
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  CHEBI ontology 0
    subatomic particle 0
      composite particle 0
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          baryon 0
            nucleon 0
              atomic nucleus 0
                atom 0
                  main group element atom 0
                    p-block element atom 0
                      carbon group element atom 0
                        carbon atom 0
                          organic molecular entity 0
                            heteroorganic entity 0
                              organochalcogen compound 0
                                organooxygen compound 0
                                  carbon oxoacid 0
                                    carboxylic acid 0
                                      monocarboxylic acid 0
                                        9-(2-carboxyethyl)-10-methylanthracene endoperoxide 0
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