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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:methyl vanillate
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Accession:CHEBI:46477 term browser browse the term
Definition:A benzoate ester that is the methyl ester of vanillic acid.
Synonyms:exact_synonym: methyl 4-hydroxy-3-methoxybenzoate
 related_synonym: 4-Hydroxy-3-methoxybenzoic acid methyl ester;   Formula=C9H10O4;   InChI=1S/C9H10O4/c1-12-8-5-6(9(11)13-2)3-4-7(8)10/h3-5,10H,1-2H3;   InChIKey=BVWTXUYLKBHMOX-UHFFFAOYSA-N;   Methyl 3-methoxy-4-hydroxybenzoate;   Methyl Vanillic Acid;   SMILES=COC(=O)c1ccc(O)c(OC)c1;   VANILLATE;   Vanillic acid, methyl ester
 xref: Beilstein:1369113;   CAS:3943-74-6
 xref_mesh: MESH:C000618837
 xref: PDBeChem:VXX;   PMID:22313772;   Reaxys:1369113


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methyl vanillate term browser
Symbol Object Name Qualifiers Evidence Notes Source PubMed Reference(s) RGD Reference(s) Position
G Duox2 dual oxidase 2 increases expression ISO methyl vanillate results in increased expression of DUOX2 mRNA CTD PMID:35523312 NCBI chr 3:109,223,809...109,247,023
Ensembl chr 3:109,226,924...109,245,902 		JBrowse link
G Nox4 NADPH oxidase 4 decreases expression ISO methyl vanillate results in decreased expression of NOX4 mRNA CTD PMID:35523312 NCBI chr 1:140,900,886...141,078,844
Ensembl chr 1:140,901,097...141,077,406 		JBrowse link
Term paths to the root
Path 1
Term Annotations click to browse term
  CHEBI ontology 19848
    role 19824
      chemical role 19460
        antioxidant 16146
          methyl vanillate 2
            methyl 4-acetoxy-3-methoxybenzoate 0
Path 2
Term Annotations click to browse term
  CHEBI ontology 19848
    subatomic particle 19846
      composite particle 19846
        hadron 19846
          baryon 19846
            nucleon 19846
              atomic nucleus 19846
                atom 19846
                  main group element atom 19796
                    p-block element atom 19796
                      carbon group element atom 19741
                        carbon atom 19737
                          organic molecular entity 19737
                            heteroorganic entity 19495
                              organochalcogen compound 19257
                                organooxygen compound 19175
                                  carbon oxoacid 18641
                                    carboxylic acid 18638
                                      aromatic carboxylic acid 12617
                                        benzoic acids 12594
                                          benzoic acid 5335
                                            hydroxybenzoic acid 4806
                                              monohydroxybenzoic acid 2620
                                                vanillic acid 41
                                                  methyl vanillate 2
                                                    methyl 4-acetoxy-3-methoxybenzoate 0
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