CHEBI:20367 - 4-formylsalicylic acid

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ChEBI Name 4-formylsalicylic acid ChEBI ID CHEBI:20367 Definition A hydroxybenzoic acid that is salicylic acid in which the hydrogen at position 4 is substituted by a formyl group. Stars This entity has been manually annotated by the ChEBI Team. Secondary ChEBI IDs CHEBI:34404 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 C8H6O4 Net Charge 0 Average Mass 166.13080 Monoisotopic Mass 166.02661 InChI InChI=1S/C8H6O4/c9-4-5-1-2-6(8(11)12)7(10)3-5/h1-4,10H,(H,11,12) InChIKey JQSSYLDZHAPSJO-UHFFFAOYSA-N SMILES OC(=O)c1ccc(C=O)cc1O Roles Classification Chemical Role(s): Bronsted acid A molecular entity capable of donating a hydron to an acceptor (Bronsted base). (via oxoacid ) View more via ChEBI Ontology ChEBI Ontology Outgoing 4-formylsalicylic acid (CHEBI:20367) has functional parent salicylic acid (CHEBI:16914) 4-formylsalicylic acid (CHEBI:20367) is a aldehyde (CHEBI:17478) 4-formylsalicylic acid (CHEBI:20367) is a monohydroxybenzoic acid (CHEBI:25389) 4-formylsalicylic acid (CHEBI:20367) is a phenols (CHEBI:33853) IUPAC Name 4-formyl-2-hydroxybenzoic acid Synonyms Sources 4-carboxy-3-hydroxybenzaldehyde ChEBI 4-Formyl-2-hydroxybenzoic acid KEGG COMPOUND 4-Formylsalicylic acid KEGG COMPOUND Manual Xrefs Databases c0703 UM-BBD C14100 KEGG COMPOUND View more database links Registry Numbers Types Sources 1102566 Reaxys Registry Number Reaxys 51572-88-4 CAS Registry Number KEGG COMPOUND Last Modified 23 March 2011