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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:Aspochalasin N
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Accession:CHEBI:199522 term browser browse the term
Synonyms:exact_synonym: (1S,3R,9E,11S,14S,15R,16S)-9,13,14-trimethyl-16-(2-methylpropyl)-3-(2-oxopropyl)-17-azatricyclo[9.7.0.01,15]octadeca-9,12-diene-2,5,18-trione
 related_synonym: Formula=C27H39NO4;   InChI=1S/C27H39NO4/c1-15(2)10-23-24-19(6)17(4)12-21-11-16(3)8-7-9-22(30)14-20(13-18(5)29)25(31)27(21,24)26(32)28-23/h11-12,15,19-21,23-24H,7-10,13-14H2,1-6H3,(H,28,32)/b16-11+/t19-,20-,21+,23+,24+,27+/m1/s1;   InChIKey=FHPZVDQGQMHWTQ-GCHLCXQHSA-N;   SMILES=O=C1[C@@]23C(=O)N[C@H]([C@@H]2[C@H](C)C(=C[C@@H]3C=C(CCCC(C[C@H]1CC(=O)C)=O)C)C)CC(C)C
 xref: Chemspider:27024267

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  CHEBI ontology 0
    role 0
      biological role 0
        biochemical role 0
          metabolite 0
            eukaryotic metabolite 0
              fungal metabolite 0
                Aspochalasin N 0
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  CHEBI ontology 0
    subatomic particle 0
      composite particle 0
        hadron 0
          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
                            organic molecule 0
                              organic cyclic compound 0
                                organic heterocyclic compound 0
                                  organic heteropolycyclic compound 0
                                    organic heterobicyclic compound 0
                                      benzopyrrole 0
                                        isoindoles 0
                                          cytochalasin 0
                                            Aspochalasin N 0
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