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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:sarpagine
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Accession:CHEBI:9036 term browser browse the term
Definition:An indole alkaloid that is sarpagan bearing hydroxy groups at positions 10 and 17.
Synonyms:exact_synonym: sarpagan-10,17-diol
 related_synonym: 10,17-sarpagandiol;   Formula=C19H22N2O2;   InChI=1S/C19H22N2O2/c1-2-10-8-21-17-7-14-13-5-11(23)3-4-16(13)20-19(14)18(21)6-12(10)15(17)9-22/h2-5,12,15,17-18,20,22-23H,6-9H2,1H3/b10-2-/t12-,15+,17-,18-/m0/s1;   InChIKey=VTVQHYQGTTVKDE-CCUKBNNFSA-N;   SMILES=[H]\\C(C)=C1/CN2[C@@]3([H])C[C@]1([H])[C@@]([H])(CO)[C@]2([H])Cc1c3[nH]c2ccc(O)cc12;   raupin
 xref: CAS:482-68-8;   KEGG:C09239;   KNApSAcK:C00001767;   MetaCyc:CPD-4243;   Reaxys:46792


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Term paths to the root
Path 1
Term Annotations click to browse term
  CHEBI ontology 19834
    role 19810
      biological role 19808
        biochemical role 19521
          metabolite 19508
            alkaloid 7828
              indole alkaloid 1943
                sarpagine 0
                  polyneuridine aldehyde 0
Path 2
Term Annotations click to browse term
  CHEBI ontology 19834
    subatomic particle 19832
      composite particle 19832
        hadron 19832
          baryon 19832
            nucleon 19832
              atomic nucleus 19832
                atom 19832
                  main group element atom 19782
                    main group molecular entity 19782
                      s-block molecular entity 19620
                        hydrogen molecular entity 19607
                          hydrides 19113
                            inorganic hydride 18117
                              pnictogen hydride 18106
                                nitrogen hydride 18013
                                  azane 17821
                                    ammonia 17820
                                      organic amino compound 17820
                                        tertiary amino compound 10138
                                          sarpagine 0
                                            polyneuridine aldehyde 0
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