n5-Iminoethyl-l-ornithine

Base Information

• Chemical Name: n5-Iminoethyl-l-ornithine
• CAS No.: 36889-13-1
• Molecular Formula: C7H15N3O2
• Molecular Weight: 173.2129
• Hs Code.: 29224985
• UNII: XQ6P9GL3YT
• DSSTox Substance ID: DTXSID50958082
• Nikkaji Number: J122.634G
• Wikidata: Q82938586
• Pharos Ligand ID: Q6D14GKD8JBU
• Metabolomics Workbench ID: 147832
• ChEMBL ID: CHEMBL11471
• Mol file: 36889-13-1.mol

Synonyms:L-NIO;N(G)-iminoethylornithine;N5-(1-iminoethyl)-L-ornithine

Chemical Property of n5-Iminoethyl-l-ornithine

Chemical Property:

• Appearance/Colour: white powder.
• Vapor Pressure: 4E-06mmHg at 25°C
• Melting Point: 225-226oC
• Boiling Point: 358.9 °C at 760 mmHg
• Flash Point: 170.9 °C
• PSA: 99.20000
• Density: 1.26 g/cm³
• LogP: 0.95620
• Storage Temp.: -20°C
• Solubility.: Methanol (Slightly), Water (Slightly)
• XLogP3: -3.6
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 5
• Exact Mass: 173.116426730
• Heavy Atom Count: 12
• Complexity: 180

Purity/Quality:

98%Min ^*data from raw suppliers

L-NIO dihydrochloride ^*data from reagent suppliers

Safty Information:

• Safety Statements: 24/25

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(=NCCCC(C(=O)O)N)N
• Isomeric SMILES: CC(=NCCC[C@@H](C(=O)O)N)N
• Description: L-NIO is a non-selective inhibitor of all NOS isoforms. The Ki values for nNOS (rat), eNOS (bovine), and iNOS (mouse) are 1.7, 3.9, and 3.9 μM, respectively. L-NIO inhibits endothelial-dependent relaxation induced by acetylcholine in rat aortic rings and hypotensive responses to acetylcholine and bradykinin.
• Uses: A potent and reversible inhibitor of NO synthase of adrenal glands, brain, and vascular endothelial cells