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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-cis-10'-apo-beta-carotenal
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Accession:CHEBI:67192 term browser browse the term
Definition:An enal that is the 9-cis-isomer of 10'-apo-beta-carotenal.
Synonyms:exact_synonym: (2E,4E,6E,8E,10E,12Z,14E)-4,9,13-trimethyl-15-(2,6,6-trimethylcyclohex-1-en-1-yl)pentadeca-2,4,6,8,10,12,14-heptaenal
 related_synonym: Formula=C27H36O;   InChI=1S/C27H36O/c1-22(12-7-8-13-23(2)16-11-21-28)14-9-15-24(3)18-19-26-25(4)17-10-20-27(26,5)6/h7-9,11-16,18-19,21H,10,17,20H2,1-6H3/b8-7+,14-9+,16-11+,19-18+,22-12+,23-13+,24-15-;   InChIKey=PJEHRCCPERVGEC-OLTPUEGQSA-N;   SMILES=[H]C(=O)\\C=C\\C(C)=C\\C=C\\C=C(C)\\C=C\\C=C(C)/C=C/C1=C(C)CCCC1(C)C
 xref: MetaCyc:CPD-14647;   PMID:22422982


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  CHEBI ontology 2
    chemical entity 2
      atom 2
        nonmetal atom 2
          carbon atom 2
            organic molecular entity 2
              olefinic compound 0
                enal 0
                  9-cis-10'-apo-beta-carotenal 0
Path 2
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  CHEBI ontology 2
    subatomic particle 2
      composite particle 2
        hadron 2
          baryon 2
            nucleon 2
              atomic nucleus 2
                atom 2
                  main group element atom 2
                    p-block element atom 2
                      carbon group element atom 2
                        carbon atom 2
                          organic molecular entity 2
                            heteroorganic entity 2
                              organochalcogen compound 1
                                organooxygen compound 0
                                  carbon oxoacid 0
                                    carboxylic acid 0
                                      carboacyl group 0
                                        univalent carboacyl group 0
                                          formyl group 0
                                            aldehyde 0
                                              alpha,beta-unsaturated aldehyde 0
                                                enal 0
                                                  9-cis-10'-apo-beta-carotenal 0
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