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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:1-(1,3-benzodioxol-5-yl)-4,4-dimethyl-1-penten-3-ol
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Accession:CHEBI:94435 term browser browse the term
Definition:A phenylpropanoid that has formula C14H18O3.
Synonyms:related_synonym: Formula=C14H18O3;   InChI=1S/C14H18O3/c1-14(2,3)13(15)7-5-10-4-6-11-12(8-10)17-9-16-11/h4-8,13,15H,9H2,1-3H3;   InChIKey=IBLNKMRFIPWSOY-UHFFFAOYSA-N;   SMILES=CC(C)(C)C(C=CC1=CC2=C(C=C1)OCO2)O;   diacomit;   estiripentol
 xref: CAS:49763-96-4;   Drug_Central:2480;   LINCS:LSM-5136
 xref_mesh: MESH:C021092


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1-(1,3-benzodioxol-5-yl)-4,4-dimethyl-1-penten-3-ol term browser
Symbol Object Name Qualifiers Evidence Notes Source PubMed Reference(s) RGD Reference(s) Position
G Cyp1a2 cytochrome P450, family 1, subfamily a, polypeptide 2 decreases activity ISO stiripentol results in decreased activity of CYP1A2 protein CTD PMID:16022579 NCBI chr 8:62,451,360...62,458,244
Ensembl chr 8:62,451,329...62,458,301
JBrowse link
G Cyp2c6v1 cytochrome P450, family 2, subfamily C, polypeptide 6, variant 1 decreases activity ISO stiripentol results in decreased activity of CYP2C19 protein CTD PMID:16022579 NCBI chr 1:147,713,879...147,814,410
Ensembl chr 1:147,713,892...147,888,007
JBrowse link

Term paths to the root
Path 1
Term Annotations click to browse term
  CHEBI ontology 19816
    chemical entity 19816
      group 19728
        polyatomic entity 19727
          molecule 19554
            cyclic compound 19359
              organic cyclic compound 19320
                organic aromatic compound 19154
                  phenylpropanoid 9281
                    1-(1,3-benzodioxol-5-yl)-4,4-dimethyl-1-penten-3-ol 2
Path 2
Term Annotations click to browse term
  CHEBI ontology 19816
    subatomic particle 19814
      composite particle 19814
        hadron 19814
          baryon 19814
            nucleon 19814
              atomic nucleus 19814
                atom 19814
                  main group element atom 19702
                    p-block element atom 19702
                      p-block molecular entity 19702
                        carbon group molecular entity 19608
                          organic molecular entity 19597
                            organic molecule 19522
                              organic cyclic compound 19320
                                organic aromatic compound 19154
                                  phenylpropanoid 9281
                                    1-(1,3-benzodioxol-5-yl)-4,4-dimethyl-1-penten-3-ol 2
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