N2-Decanoyl-L-glutamine - CAS 26060-95-7

Technical Data

IUPAC Name:	(2S)-5-amino-2-(decanoylamino)-5-oxopentanoic acid
Description:	L-Glutamine derivative used in the preparation of peptides containing arparagine and glutamine residues. N2-Decanoyl-L-glutamine has potential use in cosmetics as a constituent of deodorants. N2-Decanoyl-L-glutamine is also a potential hair growth promoter.
Molecular Weight:	300.39
Molecular Formula:	C15H28N2O4
Canonical SMILES:	CCCCCCCCCC(=O)NC(CCC(=O)N)C(=O)O
InChI:	InChI=1S/C15H28N2O4/c1-2-3-4-5-6-7-8-9-14(19)17-12(15(20)21)10-11-13(16)18/h12H,2-11H2,1H3,(H2,16,18)(H,17,19)(H,20,21)/t12-/m0/s1
InChI Key:	MZUBOXLGCNTCGH-LBPRGKRZSA-N
References:	Miroshnikov, A.I. et al. Zhur. Obsch.i Khim., 40, 223 (1970).

Complexity:	332
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	1
Defined Bond Stereocenter Count:	0
Exact Mass:	300.20490738
Formal Charge:	0
Heavy Atom Count:	21
Hydrogen Bond Acceptor Count:	4
Hydrogen Bond Donor Count:	3
Isotope Atom Count:	0
Monoisotopic Mass:	300.20490738
Rotatable Bond Count:	13
Topological Polar Surface Area:	110Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	2.5