S-(6-Purinyl)Glutathione
[CAS# 136040-02-3]

Identification

• Name: S-(6-Purinyl)Glutathione
• Synonyms: (2S)-2-Amino-5-[[(2R)-2-Amino-3-(7H-Purin-6-Ylsulfanyl)Propanoyl]-(Carboxymethyl)Amino]-5-Oxo-Pentanoic Acid; (2S)-2-Amino-5-[[(2R)-2-Amino-1-Oxo-3-(7H-Purin-6-Ylthio)Propyl]-(Carboxymethyl)Amino]-5-Oxopentanoic Acid; (2S)-2-Amino-5-[[(2R)-2-Amino-3-(7H-Purin-6-Ylthio)Propanoyl]-(Carboxymethyl)Amino]-5-Keto-Valeric Acid
• Molecular Formula: C₁₅H₁₉N₇O₆S
• Molecular Weight: 425.42
• CAS Registry Number: 136040-02-3
• SMILES: [C@@H](N)(C(=O)N(C(=O)CC[C@H](N)C(O)=O)CC(O)=O)CSC1=NC=NC2=C1[NH]C=N2
• InChI: 1S/C15H19N7O6S/c16-7(15(27)28)1-2-9(23)22(3-10(24)25)14(26)8(17)4-29-13-11-12(19-5-18-11)20-6-21-13/h5-8H,1-4,16-17H2,(H,24,25)(H,27,28)(H,18,19,20,21)/t7-,8-/m0/s1
• InChIKey: FFQGDEVBDCNBBY-YUMQZZPRSA-N

Properties

• Density: 1.656g/cm³ (Cal.)
• Boiling point: 856.078°C at 760 mmHg (Cal.)
• Flash point: 471.539°C (Cal.)