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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:parfumine
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Accession:CHEBI:68994 term browser browse the term
Definition:A benzylisoquinoline alkaloid isolated from Fumaria vaillantii and Fumaria parviflora.
Synonyms:exact_synonym: (7S)-7'-hydroxy-6'-methoxy-2'-methyl-3',4'-dihydro-2H,2'H-spiro[indeno[4,5-d][1,3]dioxole-7,1'-isoquinolin]-8(6H)-one
 related_synonym: Formula=C20H19NO5;   InChI=1S/C20H19NO5/c1-21-6-5-11-7-16(24-2)14(22)8-13(11)20(21)9-12-3-4-15-18(26-10-25-15)17(12)19(20)23/h3-4,7-8,22H,5-6,9-10H2,1-2H3/t20-/m0/s1;   InChIKey=AHNUBWYOIHCGFN-FQEVSTJZSA-N;   SMILES=COc1cc2CCN(C)[C@@]3(Cc4ccc5OCOc5c4C3=O)c2cc1O
 alt_id: CHEBI:7929
 xref: CAS:28230-70-8;   KEGG:C09599;   KNApSAcK:C00001900;   PMID:22029392;   PMID:25359679;   Reaxys:4578623


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Term Annotations click to browse term
  CHEBI ontology 19773
    role 19719
      biological role 19719
        biochemical role 19312
          metabolite 19294
            eukaryotic metabolite 18958
              plant metabolite 17449
                parfumine 0
Path 2
Term Annotations click to browse term
  CHEBI ontology 19773
    subatomic particle 19772
      composite particle 19772
        hadron 19772
          baryon 19772
            nucleon 19772
              atomic nucleus 19772
                atom 19772
                  main group element atom 19662
                    p-block element atom 19662
                      carbon group element atom 19579
                        carbon atom 19569
                          organic molecular entity 19569
                            heteroorganic entity 19207
                              organonitrogen compound 18366
                                alkaloid 5647
                                  isoquinoline alkaloid 1133
                                    benzylisoquinoline alkaloid 215
                                      parfumine 0
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