Glutamylselenocystathionine
[CAS# 59935-52-3]

Identification

• Name: Glutamylselenocystathionine
• Synonyms: (8S)-2,8-Diamino-4-(2-Amino-3-Hydroxy-3-Oxo-Propyl)Selanyl-5-Oxo-Nonanedioic Acid; (8S)-2,8-Diamino-4-[(2-Amino-3-Hydroxy-3-Oxopropyl)Seleno]-5-Oxononanedioic Acid; (8S)-2,8-Diamino-4-[(2-Amino-3-Hydroxy-3-Keto-Propyl)Seleno]-5-Keto-Azelaic Acid
• Molecular Formula: C₁₂H₂₁N₃O₇Se
• Molecular Weight: 398.27
• CAS Registry Number: 59935-52-3
• SMILES: [C@H](C(=O)O)(N)CCC(C(CC(C(=O)O)N)[Se]CC(C(=O)O)N)=O
• InChI: 1S/C12H21N3O7Se/c13-5(10(17)18)1-2-8(16)9(3-6(14)11(19)20)23-4-7(15)12(21)22/h5-7,9H,1-4,13-15H2,(H,17,18)(H,19,20)(H,21,22)/t5-,6?,7?,9?/m0/s1
• InChIKey: POUZOIPGAASHFN-AJTLONOZSA-N

Properties

• Boiling point: 718.052°C at 760 mmHg (Cal.)
• Flash point: 388.064°C (Cal.)

References

• (1): Dernovics Mihaly. Standardless identification of selenocystathionine and its γ-glutamyl derivatives in monkeypot nuts by 3D liquid chromatography with ICP-MS detection followed by nanoHPLC-Q-TOF-MS/MS, The Analyst, 2007