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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:2''-hydroxycannabidiol
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Accession:CHEBI:133058 term browser browse the term
Definition:A hydroxy-cannabidiol that is cannabidiol in which one of the two hydrogens at position 2 of the pentyl chain has been replaced by a hydroxy group. It is a metabolite of cannabidiol by human liver microsomes, produced by CYP3A.
Synonyms:exact_synonym: (1'R,2'R)-4-(2-hydroxypentyl)-5'-methyl-2'-(prop-1-en-2-yl)-1',2',3',4'-tetrahydrobiphenyl-2,6-diol
 related_synonym: 2''-HO-CBD;   2''-HO-cannabidiol;   2''-OH-CBD;   2''-OH-cannabidiol;   2''-hydroxy-CBD;   2''-hydroxy-cannabidiol;   Formula=C21H30O3;   InChI=1S/C21H30O3/c1-5-6-16(22)10-15-11-19(23)21(20(24)12-15)18-9-14(4)7-8-17(18)13(2)3/h9,11-12,16-18,22-24H,2,5-8,10H2,1,3-4H3/t16?,17-,18+/m0/s1;   InChIKey=PVRJAZVKVQMBIZ-UQJFVLDMSA-N;   SMILES=C=1(C(=CC(=CC1O)CC(CCC)O)O)[C@H]2[C@](CCC(=C2)C)([H])C(C)=C
 xref: PMID:21704641;   Reaxys:22690712


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Path 1
Term Annotations click to browse term
  CHEBI ontology 19890
    role 19839
      biological role 19858
        antimicrobial agent 18239
          cannabidiol 1411
            hydroxy-cannabidiol 0
              2''-hydroxycannabidiol 0
Path 2
Term Annotations click to browse term
  CHEBI ontology 19890
    subatomic particle 19867
      composite particle 19888
        hadron 19888
          baryon 19888
            nucleon 19867
              atomic nucleus 19888
                atom 19888
                  main group element atom 19806
                    p-block element atom 19806
                      carbon group element atom 19746
                        carbon atom 19743
                          organic molecular entity 19743
                            organic molecule 19714
                              organic cyclic compound 19485
                                organic aromatic compound 19350
                                  phenols 18641
                                    benzenediols 9163
                                      resorcinols 7364
                                        cannabidiol 1411
                                          hydroxy-cannabidiol 0
                                            2''-hydroxycannabidiol 0
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