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1190-49-4

1190-49-4 structural image
Product Name: L-HOMOCITRULLINE
Formula: C7H15N3O3
Synonyms: Homocitrulline;N6-(Aminocarbonyl)-L-lysine;NSC 27428
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CHEMICAL AND PHYSICAL PROPERTIES

Physical Description Solid
Melting Point 211 - 212 °C
Solubility 600 mg/mL

COMPUTED DESCRIPTORS

Molecular Weight 189.21 g/mol
XLogP3 -3.9
Hydrogen Bond Donor Count 4
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 6
Exact Mass 189.11134135 g/mol
Monoisotopic Mass 189.11134135 g/mol
Topological Polar Surface Area 118 Ų
Heavy Atom Count 13
Formal Charge 0
Complexity 184
Isotope Atom Count 0
Defined Atom Stereocenter Count 1
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes

PRODUCT INTRODUCTION

description

L-homocitrulline is a L-lysine derivative that is L-lysine having a carbamoyl group at the N(6)-position. It is found in individuals with urea cycle disorders. It has a role as a mouse metabolite and a human metabolite. It is a member of ureas, a L-lysine derivative and a non-proteinogenic L-alpha-amino acid. It is a tautomer of a L-homocitrulline zwitterion.