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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:Mezerein
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Accession:CHEBI:6918 term browser browse the term
Definition:A diterpenoid that has formula C38H38O10.
Synonyms:related_synonym: Formula=C38H38O10;   InChI=1S/C38H38O10/c1-21(2)36-30(44-27(40)18-12-11-15-24-13-7-5-8-14-24)23(4)37-26-19-22(3)29(41)35(26,43)33(42)34(20-39)31(45-34)28(37)32(36)46-38(47-36,48-37)25-16-9-6-10-17-25/h5-19,23,26,28,30-33,39,42-43H,1,20H2,2-4H3/b15-11+,18-12+/t23-,26-,28+,30-,31+,32-,33-,34+,35-,36+,37+,38?/m1/s1;   InChIKey=DLEDLHFNQDHEOJ-HBJWEEFJSA-N;   SMILES=C[C@@H]1[C@@H](OC(=O)\\C=C\\C=C\\c2ccccc2)[C@@]2(OC3(O[C@@H]2[C@@H]2[C@@H]4O[C@]4(CO)[C@@H](O)[C@@]4(O)[C@@H](C=C(C)C4=O)[C@@]12O3)c1ccccc1)C(C)=C
 xref: CAS:34807-41-5;   KEGG:C09134;   KNApSAcK:C00003454
 xref_mesh: MESH:C011309


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  CHEBI ontology 2
    chemical entity 2
      atom 2
        nonmetal atom 2
          carbon atom 2
            organic molecular entity 2
              isoprenoid 0
                terpenoid 0
                  diterpenoid 0
                    Mezerein 0
Path 2
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  CHEBI ontology 2
    subatomic particle 2
      composite particle 2
        hadron 2
          baryon 2
            nucleon 2
              atomic nucleus 2
                atom 2
                  main group element atom 2
                    main group molecular entity 2
                      s-block molecular entity 1
                        hydrogen molecular entity 1
                          hydrides 1
                            organic hydride 0
                              organic fundamental parent 0
                                hydrocarbon 0
                                  terpene 0
                                    diterpene 0
                                      diterpenoid 0
                                        Mezerein 0
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