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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:neotriptophenolide
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Accession:CHEBI:132346 term browser browse the term
Definition:A tetracyclic diterpenoid with formula C21H26O4, originally isolated from Tripterygium wilfordii and Tripterygium hypoglaucum
Synonyms:exact_synonym: (3bR,9bS)-9-hydroxy-6-methoxy-9b-methyl-7-(propan-2-yl)-3b,4,5,9b,10,11-hexahydrophenanthro[1,2-c]furan-1(3H)-one
 related_synonym: Formula=C21H26O4;   InChI=1S/C21H26O4/c1-11(2)14-9-17(22)18-13(19(14)24-4)5-6-16-15-10-25-20(23)12(15)7-8-21(16,18)3/h9,11,16,22H,5-8,10H2,1-4H3/t16-,21-/m0/s1;   InChIKey=YQHBJMHUMJXFDN-KKSFZXQISA-N;   SMILES=O1CC=2[C@]3([C@](CCC2C1=O)(C=4C(CC3)=C(OC)C(=CC4O)C(C)C)C)[H]
 xref: CAS:81827-74-9;   KNApSAcK:C00037548;   PMID:7102323;   Pubchem:133766;   Reaxys:7391194


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  CHEBI ontology 495
    role 495
      biological role 495
        biochemical role 455
          metabolite 446
            eukaryotic metabolite 424
              plant metabolite 91
                neotriptophenolide 0
Path 2
Term Annotations click to browse term
  CHEBI ontology 495
    subatomic particle 495
      composite particle 495
        hadron 495
          baryon 495
            nucleon 495
              atomic nucleus 495
                atom 495
                  main group element atom 488
                    main group molecular entity 488
                      s-block molecular entity 433
                        hydrogen molecular entity 432
                          hydrides 363
                            organic hydride 71
                              organic fundamental parent 71
                                hydrocarbon 49
                                  terpene 20
                                    terpenoid 20
                                      triterpenoid 2
                                        tetracyclic triterpenoid 0
                                          neotriptophenolide 0
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