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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:safranal
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Accession:CHEBI:53169 term browser browse the term
Definition:A monoterpenoid formally derived from beta-cyclocitral by dehydrogenation.
Synonyms:exact_synonym: 2,6,6-trimethylcyclohexa-1,3-diene-1-carbaldehyde
 related_synonym: 1,1,3-Trimethyl-2-formylcyclohexa-2,4-diene;   2,6,6-Trimethylcyclohexa-1,3-dienyl methanal;   2,6,6-trimethyl-1,3-cyclohexadiene-1-carboxaldehyde;   Dehydro-beta-cyclocitral;   Formula=C10H14O;   InChI=1S/C10H14O/c1-8-5-4-6-10(2,3)9(8)7-11/h4-5,7H,6H2,1-3H3;   InChIKey=SGAWOGXMMPSZPB-UHFFFAOYSA-N;   SMILES=CC1=C(C=O)C(C)(C)CC=C1
 xref: CAS:116-26-7;   KEGG:C17062
 xref_mesh: MESH:C087963



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safranal term browser
Symbol Object Name Qualifiers Evidence Notes Source PubMed Reference(s) RGD Reference(s) Position
G Calca calcitonin-related polypeptide alpha increases secretion
multiple interactions
ISO
EXP
safranal results in increased secretion of CALCA protein
2-(1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl)-N-(4-isopropylphenyl)acetamide inhibits the reaction [safranal results in increased secretion of CALCA protein]; [Capsaicin results in decreased susceptibility to safranal] which results in decreased secretion of CALCA protein; Calcium deficiency inhibits the reaction [safranal results in increased secretion of CALCA protein]; safranal inhibits the reaction [allyl isothiocyanate results in increased secretion of CALCA protein]
2-(1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl)-N-(4-isopropylphenyl)acetamide inhibits the reaction [safranal results in increased secretion of CALCA protein]; TRPA1 gene mutant form inhibits the reaction [safranal results in increased secretion of CALCA protein]
CTD PMID:30636360 NCBI chr 1:168,878,212...168,883,176
Ensembl chr 1:168,878,214...168,883,105
JBrowse link
G Trpa1 transient receptor potential cation channel, subfamily A, member 1 multiple interactions
increases activity
ISO TRPA1 gene mutant form inhibits the reaction [safranal results in increased secretion of CALCA protein]
safranal results in increased activity of TRPA1 protein
2-(1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl)-N-(4-isopropylphenyl)acetamide inhibits the reaction [safranal results in increased activity of TRPA1 protein]
CTD PMID:30636360 NCBI chr 5:4,379,999...4,433,243
Ensembl chr 5:4,379,999...4,433,570
JBrowse link

Term paths to the root
Path 1
Term Annotations click to browse term
  CHEBI ontology 19795
    role 19746
      biological role 19746
        biochemical role 19361
          metabolite 19338
            prokaryotic metabolite 18406
              bacterial metabolite 18406
                beta-cyclocitral 2
                  safranal 2
Path 2
Term Annotations click to browse term
  CHEBI ontology 19795
    subatomic particle 19794
      composite particle 19794
        hadron 19794
          baryon 19794
            nucleon 19794
              atomic nucleus 19794
                atom 19794
                  main group element atom 19693
                    main group molecular entity 19693
                      s-block molecular entity 19474
                        hydrogen molecular entity 19466
                          hydrides 18830
                            organic hydride 18346
                              organic fundamental parent 18346
                                hydrocarbon 18057
                                  terpene 12723
                                    monoterpene 2868
                                      monoterpenoid 1224
                                        beta-cyclocitral 2
                                          safranal 2
paths to the root