N6-L-Lysyl-L-lysine - CAS 94613-75-9

Catalog:	BB060451
Product Name:	N6-L-Lysyl-L-lysine
CAS:	94613-75-9
Synonyms:	N~6~-L-Lysyl-L-Lysine; N6-L-Lysyl-L-lysine; L-Lysine, N6-L-lysyl-

Technical Data

IUPAC Name:	(2S)-2-amino-6-[[(2S)-2,6-diaminohexanoyl]amino]hexanoic acid
Description:	N6-L-Lysyl-L-lysine is a dimer of DL-Lysine (L488505). DL-Lysine is a racemic mixture of the D and L enantiomers of lysine amino acid. Used in the synthesis of proteins, alkaloids and other chemical compounds. Used as a precursor in biosynthesis of Marcfortine A.
Molecular Weight:	274.36
Molecular Formula:	C12H26N4O3
Canonical SMILES:	C(CCN)CC(C(=O)NCCCCC(C(=O)O)N)N
InChI:	InChI=1S/C12H26N4O3/c13-7-3-1-5-9(14)11(17)16-8-4-2-6-10(15)12(18)19/h9-10H,1-8,13-15H2,(H,16,17)(H,18,19)/t9-,10-/m0/s1
InChI Key:	ISWYJQKGNGBKJG-UWVGGRQHSA-N
References:	Kuo, M., et al. J. Antibiot., 49, 1006 (1996).

Complexity:	274
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	2
Defined Bond Stereocenter Count:	0
Exact Mass:	274.2004907
Formal Charge:	0
Heavy Atom Count:	19
Hydrogen Bond Acceptor Count:	6
Hydrogen Bond Donor Count:	5
Isotope Atom Count:	0
Monoisotopic Mass:	274.2004907
Rotatable Bond Count:	11
Topological Polar Surface Area:	145Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	-3.7