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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:25-azacoprostane
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Accession:CHEBI:78726 term browser browse the term
Definition:An aza-steroid that is 5beta-cholestane in which the carbon at position 25 is replaced by a nitrogen. It inhibits sitosterol-to-cholesterol conversion in Caenorhabditis elegans.
Synonyms:exact_synonym: (5beta)-N,N-dimethylcholan-24-amine
 related_synonym: Formula=C26H47N;   InChI=1S/C26H47N/c1-19(9-8-18-27(4)5)22-13-14-23-21-12-11-20-10-6-7-16-25(20,2)24(21)15-17-26(22,23)3/h19-24H,6-18H2,1-5H3/t19-,20+,21+,22-,23+,24+,25+,26-/m1/s1;   InChIKey=LJQDDVJEZIEHNY-FHNVJLOUSA-N;   SMILES=C[C@H](CCCN(C)C)[C@H]1CC[C@H]2[C@@H]3CC[C@@H]4CCCC[C@]4(C)[C@H]3CC[C@]12C
 xref: CAS:37106-88-0;   PMID:12904448;   PMID:21186286;   PMID:21344279;   PMID:2608313;   PMID:3840423;   PMID:6673193;   Reaxys:3140801


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Term Annotations click to browse term
  CHEBI ontology 19909
    role 19880
      application 19720
        NMR chemical shift reference compound 18090
          ammonia 17888
            organic amino compound 17888
              amine 8310
                tertiary amine 645
                  25-azacoprostane 0
Path 2
Term Annotations click to browse term
  CHEBI ontology 19909
    subatomic particle 19907
      composite particle 19907
        hadron 19907
          baryon 19907
            nucleon 19907
              atomic nucleus 19907
                atom 19907
                  main group element atom 19846
                    main group molecular entity 19846
                      s-block molecular entity 19679
                        hydrogen molecular entity 19661
                          hydrides 19163
                            inorganic hydride 18182
                              pnictogen hydride 18172
                                nitrogen hydride 18079
                                  azane 17889
                                    ammonia 17888
                                      organic amino compound 17888
                                        tertiary amino compound 10171
                                          tertiary amine 645
                                            25-azacoprostane 0
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