CHEBI:37078 - 4-{[(2-amino-4-oxo-3,4-dihydropteridin-6-yl)methyl]amino}benzoate

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ChEBI Name 4-{[(2-amino-4-oxo-3,4-dihydropteridin-6-yl)methyl]amino}benzoate ChEBI ID CHEBI:37078 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 C14H11N6O3 Net Charge -1 Average Mass 311.282 Monoisotopic Mass 311.08981 InChI InChI=1S/C14H12N6O3/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/h1-4,6,16H,5H2,(H,22,23)(H3,15,17,19,20,21)/p-1 InChIKey JOAQINSXLLMRCV-UHFFFAOYSA-M SMILES NC1=NC2=C(N=C(CNC3=CC=C(C=C3)C([O-])=O)C=N2)C(=O)N1 ChEBI Ontology Outgoing 4-{[(2-amino-4-oxo-3,4-dihydropteridin-6-yl)methyl]amino}benzoate (CHEBI:37078) is a pteroate (CHEBI:38793) 4-{[(2-amino-4-oxo-3,4-dihydropteridin-6-yl)methyl]amino}benzoate (CHEBI:37078) is conjugate base of 4-{[(2-amino-4-oxo-3,4-dihydropteridin-6-yl)methyl]amino}benzoic acid (CHEBI:37055) 4-{[(2-amino-4-oxo-3,4-dihydropteridin-6-yl)methyl]amino}benzoate (CHEBI:37078) is tautomer of 4-{[(2-amino-4-hydroxypteridin-6-yl)methyl]amino}benzoate (CHEBI:26376) Incoming 4-{[(2-amino-4-oxo-3,4-dihydropteridin-6-yl)methyl]amino}benzoic acid (CHEBI:37055) is conjugate acid of 4-{[(2-amino-4-oxo-3,4-dihydropteridin-6-yl)methyl]amino}benzoate (CHEBI:37078) 4-{[(2-amino-4-hydroxypteridin-6-yl)methyl]amino}benzoate (CHEBI:26376) is tautomer of 4-{[(2-amino-4-oxo-3,4-dihydropteridin-6-yl)methyl]amino}benzoate (CHEBI:37078) IUPAC Name 4-{[(2-amino-4-oxo-3,4-dihydropteridin-6-yl)methyl]amino}benzoate Last Modified 22 August 2024