CHEBI:153570 - 3-amino-5-[(4-hydroxyphenyl)methyl]-4,4-dimethylpyrrolidin-2-one

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ChEBI Name 3-amino-5-[(4-hydroxyphenyl)methyl]-4,4-dimethylpyrrolidin-2-one ChEBI ID CHEBI:153570 Definition A member of the class of pyrrolidin-2-ones that is pyrrolidin-2-one which is substituted by an amino group at position 3, by two methyl groups at position 4 and by a 4-hydroxybenzyl group at position 5. It is a biosynthetic precursor in the synthesis of mycofactocin. 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 C13H18N2O2 Net Charge 0 Average Mass 234.299 Monoisotopic Mass 234.13683 InChI InChI=1S/C13H18N2O2/c1-13(2)10(15-12(17)11(13)14)7-8-3-5-9(16)6-4-8/h3-6,10-11,16H,7,14H2,1-2H3,(H,15,17) InChIKey MCRWIHVHOLDIFL-UHFFFAOYSA-N SMILES C1(C(NC(C1N)=O)CC=2C=CC(=CC2)O)(C)C Roles Classification Chemical Role(s): Bronsted base A molecular entity capable of accepting a hydron from a donor (Bronsted acid). (via organic amino compound ) View more via ChEBI Ontology ChEBI Ontology Outgoing 3-amino-5-[(4-hydroxyphenyl)methyl]-4,4-dimethylpyrrolidin-2-one (CHEBI:153570) is a aminopyrrolidine (CHEBI:46769) 3-amino-5-[(4-hydroxyphenyl)methyl]-4,4-dimethylpyrrolidin-2-one (CHEBI:153570) is a phenols (CHEBI:33853) 3-amino-5-[(4-hydroxyphenyl)methyl]-4,4-dimethylpyrrolidin-2-one (CHEBI:153570) is a primary amino compound (CHEBI:50994) 3-amino-5-[(4-hydroxyphenyl)methyl]-4,4-dimethylpyrrolidin-2-one (CHEBI:153570) is a pyrrolidin-2-ones (CHEBI:74223) 3-amino-5-[(4-hydroxyphenyl)methyl]-4,4-dimethylpyrrolidin-2-one (CHEBI:153570) is conjugate base of 3-amino-5-[(4-hydroxyphenyl)methyl]-4,4-dimethylpyrrolidin-2-one(1+) (CHEBI:150863) Incoming 3-amino-5-[(4-hydroxyphenyl)methyl]-4,4-dimethylpyrrolidin-2-one(1+) (CHEBI:150863) is conjugate acid of 3-amino-5-[(4-hydroxyphenyl)methyl]-4,4-dimethylpyrrolidin-2-one (CHEBI:153570) IUPAC Name 3-amino-5-(4-hydroxybenzyl)-4,4-dimethylpyrrolidin-2-one Synonym Source 3-amino-5-[(p-hydroxyphenyl) methyl]-4,4-dimethyl-2-pyrrolidinone ChEBI Citations Types Sources 30778644 PubMed citation Europe PMC 31381312 PubMed citation Europe PMC Last Modified 05 June 2020