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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:(-)-voacangine
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Accession:CHEBI:141966 term browser browse the term
Definition:A monoterpenoid indole alkaloid with formula C22H28N2O3, isolated from several plant species.
Synonyms:exact_synonym: methyl (6xi)-12-methoxy-2alpha-ibogamine-18-carboxylate
 related_synonym: 12-methoxyibogamine-18-carboxylic acid methyl ester;   Formula=C22H28N2O3;   InChI=1S/C22H28N2O3/c1-4-14-9-13-11-22(21(25)27-3)19-16(7-8-24(12-13)20(14)22)17-10-15(26-2)5-6-18(17)23-19/h5-6,10,13-14,20,23H,4,7-9,11-12H2,1-3H3/t13-,14-,20-,22+/m0/s1;   InChIKey=MMAYTCMMKJYIAM-RUGRQLENSA-N;   SMILES=CC[C@H]1C[C@]2(C[C@]3(C4=C(CCN(C2)[C@@]13[H])C=5C=C(C=CC5N4)OC)C(=O)OC)[H];   carbomethoxyibogaine
 xref: CAS:510-22-5;   KNApSAcK:C00025223;   PMID:14254313;   PMID:15357977;   PMID:17268963;   PMID:17405098;   PMID:19647051;   PMID:22155252;   PMID:23569415;   PMID:24484240;   PMID:26140390;   PMID:27448833;   PMID:29728039;   PMID:29883785;   PMID:31364847;   Patent:US2013211073;   Reaxys:55361;   Wikipedia:Voacangine
 cyclic_relationship: is_conjugate_base_of CHEBI:146230


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Term Annotations click to browse term
  CHEBI ontology 19792
    role 19738
      application 19385
        fuel 10806
          methanol 3059
            methyl ester 3048
              (-)-voacangine 0
Path 2
Term Annotations click to browse term
  CHEBI ontology 19792
    subatomic particle 19788
      composite particle 19788
        hadron 19788
          baryon 19788
            nucleon 19788
              atomic nucleus 19788
                atom 19788
                  main group element atom 19675
                    p-block element atom 19675
                      chalcogen 19382
                        oxygen atom 19343
                          oxygen molecular entity 19343
                            hydroxides 19091
                              organic hydroxy compound 18658
                                alcohol 15001
                                  aliphatic alcohol 11115
                                    alkyl alcohol 11069
                                      methanol 3059
                                        methyl ester 3048
                                          (-)-voacangine 0
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