CHEBI:63797 - 3-hydroxy-4-methoxybenzoate

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ChEBI Name 3-hydroxy-4-methoxybenzoate ChEBI ID CHEBI:63797 Definition A monohydroxybenzoate that is the conjugate base of 3-hydroxy-4-methoxybenzoic acid, arising from deprotonation of the carboxy group. Stars This entity has been manually annotated by the ChEBI Team. Supplier Information Download Molfile XML SDF Find compounds which contain this structure Find compounds which resemble this structure Take structure to the Advanced Search Formula C8H7O4 Net Charge -1 Average Mass 167.13880 Monoisotopic Mass 167.03498 InChI InChI=1S/C8H8O4/c1-12-7-3-2-5(8(10)11)4-6(7)9/h2-4,9H,1H3,(H,10,11)/p-1 InChIKey LBKFGYZQBSGRHY-UHFFFAOYSA-M SMILES COc1ccc(cc1O)C([O-])=O ChEBI Ontology Outgoing 3-hydroxy-4-methoxybenzoate (CHEBI:63797) is a methoxybenzoate (CHEBI:25236) 3-hydroxy-4-methoxybenzoate (CHEBI:63797) is a monohydroxybenzoate (CHEBI:25388) 3-hydroxy-4-methoxybenzoate (CHEBI:63797) is conjugate base of 3-hydroxy-4-methoxybenzoic acid (CHEBI:63798) Incoming 3-hydroxy-4-methoxybenzoic acid (CHEBI:63798) is conjugate acid of 3-hydroxy-4-methoxybenzoate (CHEBI:63797) IUPAC Name 3-hydroxy-4-methoxybenzoate Synonyms Sources 3-hydroxy-4-methoxybenzoate UniProt isovanillate ChEBI Registry Number Type Source 6504382 Reaxys Registry Number Reaxys Citations Types Sources 1083208 PubMed citation Europe PMC 11327601 PubMed citation Europe PMC 16707678 PubMed citation Europe PMC 7813485 PubMed citation Europe PMC Last Modified 24 May 2022