CHEBI:137340 - 8-demethyl-8-(methylamino)riboflavin

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ChEBI Name 8-demethyl-8-(methylamino)riboflavin ChEBI ID CHEBI:137340 Definition A benzopteridine that is riboflavin in which the methyl group at position 8 has been replaced by a methylamino group.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 C17H21N5O6 Net Charge 0 Average Mass 391.379 Monoisotopic Mass 391.14918 InChI InChI=1S/C17H21N5O6/c1-7-3-9-10(4-8(7)18-2)22(5-11(24)14(26)12(25)6-23)15-13(19-9)16(27)21-17(28)20-15/h3-4,11-12,14,18,23-26H,5-6H2,1-2H3,(H,21,27,28)/t11-,12+,14-/m0/s1 InChIKey PWZSYWZSTDXLFL-SCRDCRAPSA-N SMILES C(N1C=2C(=NC3=C1C=C(C(=C3)C)NC)C(NC(N2)=O)=O)[C@H](O)[C@H](O)[C@H](O)CO 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 8-demethyl-8-(methylamino)riboflavin (CHEBI:137340) has functional parent riboflavin (CHEBI:17015) 8-demethyl-8-(methylamino)riboflavin (CHEBI:137340) is a aromatic amine (CHEBI:33860) 8-demethyl-8-(methylamino)riboflavin (CHEBI:137340) is a benzopteridine (CHEBI:38925) 8-demethyl-8-(methylamino)riboflavin (CHEBI:137340) is a secondary amino compound (CHEBI:50995) 8-demethyl-8-(methylamino)riboflavin (CHEBI:137340) is a tetrol (CHEBI:33573) 8-demethyl-8-(methylamino)riboflavin (CHEBI:137340) is conjugate acid of 8-demethyl-8-(methylamino)riboflavin(1−) (CHEBI:136520) Incoming 8-demethyl-8-(methylamino)riboflavin(1−) (CHEBI:136520) is conjugate base of 8-demethyl-8-(methylamino)riboflavin (CHEBI:137340) IUPAC Name 1-deoxy-1-[7-methyl-8-(methylamino)-2,4-dioxo-3,4-dihydrobenzo[g]pteridin-10(2H)-yl]-D-ribitol Synonyms Sources 8-demethyl-8-methylaminoriboflavin ChEBI 8-Methylamino-riboflavin ChemIDplus 8-Methylaminoriboflavin ChemIDplus Manual Xref Database CPD-19834 MetaCyc View more database links Registry Numbers Types Sources 1231598 Reaxys Registry Number Reaxys 62746-55-8 CAS Registry Number ChemIDplus Citations Types Sources 21911488 PubMed citation Europe PMC 26913589 PubMed citation Europe PMC 7378475 PubMed citation Europe PMC Last Modified 06 June 2017