CHEBI:4581 - 7,8-dihydropteroic acid

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ChEBI Name 7,8-dihydropteroic acid ChEBI ID CHEBI:4581 Definition A pteroic acid derivative arising from formal hydrogenation of the 7,8-double bond of pteroic acid. 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 C14H14N6O3 Net Charge 0 Average Mass 314.29960 Monoisotopic Mass 314.11274 InChI InChI=1S/C14H14N6O3/c15-14-19-11-10(12(21)20-14)18-9(6-17-11)5-16-8-3-1-7(2-4-8)13(22)23/h1-4,16H,5-6H2,(H,22,23)(H4,15,17,19,20,21) InChIKey WBFYVDCHGVNRBH-UHFFFAOYSA-N SMILES Nc1nc2NCC(CNc3ccc(cc3)C(O)=O)=Nc2c(=O)[nH]1 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 7,8-dihydropteroic acid (CHEBI:4581) has functional parent pteroic acid (CHEBI:38794) 7,8-dihydropteroic acid (CHEBI:4581) is a pteroic acids (CHEBI:38795) 7,8-dihydropteroic acid (CHEBI:4581) is conjugate acid of 7,8-dihydropteroate (CHEBI:17839) Incoming 2-hydroxy-7,8-dihydropteroic acid (CHEBI:138237) has functional parent 7,8-dihydropteroic acid (CHEBI:4581) 7,8-dihydropteroate (CHEBI:17839) is conjugate base of 7,8-dihydropteroic acid (CHEBI:4581) IUPAC Name 4-{[(2-amino-4-oxo-3,4,7,8-tetrahydropteridin-6-yl)methyl]amino}benzoic acid Synonyms Sources 4-(((2-amino-1,4,7,8-tetrahydro-4-oxo-6-pteridinyl)methyl)amino)benzoic acid ChemIDplus 7,8-Dihydropteroate KEGG COMPOUND Dihydropteroate KEGG COMPOUND Dihydropteroinsäure ChEBI Manual Xrefs Databases C00007228 KNApSAcK C00921 KEGG COMPOUND View more database links Registry Numbers Types Sources 1226443 Reaxys Registry Number Reaxys 1226443 Beilstein Registry Number Beilstein 2134-76-1 CAS Registry Number ChemIDplus Last Modified 17 August 2017