CHEBI:132748 - sodium vanillate

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ChEBI Name sodium vanillate
ChEBI ID CHEBI:132748
Definition An organic sodium salt resulting from the replacement of the proton from the carboxy group of vanillic acid by a sodium ion.
Stars This entity has been manually annotated by the ChEBI Team.
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Formula C8H7NaO4
Net Charge 0
Average Mass 190.129
Monoisotopic Mass 190.02420
InChI InChI=1S/C8H8O4.Na/c1-12-7-4-5(8(10)11)2-3-6(7)9;/h2-4,9H,1H3,(H,10,11);/q;+1/p-1
InChIKey ZFRVFUWCVYLUIH-UHFFFAOYSA-M
SMILES C=1C=C(C=C(C1O)OC)C([O-])=O.[Na+]
ChEBI Ontology
Outgoing sodium vanillate (CHEBI:132748) has part vanillate (CHEBI:16632)
sodium vanillate (CHEBI:132748) is a organic sodium salt (CHEBI:38700)
IUPAC Name
sodium 4-hydroxy-3-methoxybenzoate
Manual Xref Database
Vanillic_acid Wikipedia
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Registry Number Type Source
9520930 Reaxys Registry Number Reaxys
Citation Waiting for Citations Type Source
20554304 PubMed citation Europe PMC
Last Modified
19 July 2016