Maltosine - CAS 121502-04-3

Catalog:	BB056390
Product Name:	Maltosine
CAS:	121502-04-3
Synonyms:	(αS)-α-Amino-3-hydroxy-2-methyl-4-oxo-1(4H)-pyridinehexanoic Acid; (S)-α-amino-3-hydroxy-2-methyl-4-oxo-1(4H)-pyridinehexanoic Acid

Technical Data

IUPAC Name:	(2S)-2-amino-6-(3-hydroxy-2-methyl-4-oxopyridin-1-yl)hexanoic acid
Description:	Maltosine is a product of the Maillard reaction with a pyridone structure. In glycation reactions, the side chains of protein-bound nucleophilic amino acids such as lysine and arginine are post-translationally modified to a variety of derivatives also known as Maillard reaction products (MRPs).
Molecular Weight:	254.28
Molecular Formula:	C12H18N2O4
Canonical SMILES:	CC1=C(C(=O)C=CN1CCCCC(C(=O)O)N)O
InChI:	InChI=1S/C12H18N2O4/c1-8-11(16)10(15)5-7-14(8)6-3-2-4-9(13)12(17)18/h5,7,9,16H,2-4,6,13H2,1H3,(H,17,18)/t9-/m0/s1
InChI Key:	XREGTYIADDPJMA-VIFPVBQESA-N
References:	Ahmed, M., et al. J. Biol. Chem., 261, 4889 (1986), Ahmed, N., et al. Diabetes Obes. Metab., 9, 233 (2007), Hellwig, M., et al. ChemBioChem, 12, 1270 (2011),.

Complexity:	401
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	1
Defined Bond Stereocenter Count:	0
Exact Mass:	254.12665706
Formal Charge:	0
Heavy Atom Count:	18
Hydrogen Bond Acceptor Count:	6
Hydrogen Bond Donor Count:	3
Isotope Atom Count:	0
Monoisotopic Mass:	254.12665706
Rotatable Bond Count:	6
Topological Polar Surface Area:	104Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	-2