N5-[Imino(nitroamino)methyl]-L-Ornithine methyl ester
[CAS# 50903-99-6]

Identification

• Name: N5-[Imino(nitroamino)methyl]-L-Ornithine methyl ester
• Synonyms: Methyl (2S)-2-Amino-5-[(Amino-Nitramido-Methylene)Amino]Pentanoate; (2S)-2-Amino-5-[(Amino-Nitramidomethylene)Amino]Pentanoic Acid Methyl Ester; (2S)-2-Amino-5-[(Amino-Nitramido-Methylene)Amino]Valeric Acid Methyl Ester
• Molecular Formula: C₇H₁₅N₅O₄
• Molecular Weight: 233.23
• CAS Registry Number: 50903-99-6
• SMILES: [C@H](N)(CCCN=C(N[N+]([O-])=O)N)C(OC)=O
• InChI: 1S/C7H15N5O4/c1-16-6(13)5(8)3-2-4-10-7(9)11-12(14)15/h5H,2-4,8H2,1H3,(H3,9,10,11)/t5-/m0/s1
• InChIKey: KCWZGJVSDFYRIX-YFKPBYRVSA-N

Properties

• Density: 1.489g/cm³ (Cal.)
• Boiling point: 383.533°C at 760 mmHg (Cal.)
• Flash point: 185.755°C (Cal.)

References

• (1): Yoshida et al.. Nitric oxide activates TRP channels by cysteine S-nitrosylation, Nature Chemical Biology, 2006