2-(S-Glutathionyl)Hydroquinone
[CAS# 76726-99-3]

Identification

• Name: 2-(S-Glutathionyl)Hydroquinone
• Synonyms: (2S)-2-Amino-5-[[(1R)-2-(Carboxymethylamino)-1-[(2,5-Dihydroxyphenyl)Sulfanylmethyl]-2-Oxo-Ethyl]Amino]-5-Oxo-Pentanoic Acid; (2S)-2-Amino-5-[[(1R)-2-(Carboxymethylamino)-1-[[(2,5-Dihydroxyphenyl)Thio]Methyl]-2-Oxoethyl]Amino]-5-Oxopentanoic Acid; (2S)-2-Amino-5-[[(1R)-2-(Carboxymethylamino)-1-[[(2,5-Dihydroxyphenyl)Thio]Methyl]-2-Keto-Ethyl]Amino]-5-Keto-Valeric Acid
• Molecular Formula: C₁₆H₂₁N₃O₈S
• Molecular Weight: 415.42
• CAS Registry Number: 76726-99-3
• SMILES: [C@@H](NC(=O)CC[C@H](N)C(=O)O)(C(=O)NCC(=O)O)CSC1=C(O)C=CC(=C1)O
• InChI: 1S/C16H21N3O8S/c17-9(16(26)27)2-4-13(22)19-10(15(25)18-6-14(23)24)7-28-12-5-8(20)1-3-11(12)21/h1,3,5,9-10,20-21H,2,4,6-7,17H2,(H,18,25)(H,19,22)(H,23,24)(H,26,27)/t9-,10-/m0/s1
• InChIKey: PBSYQNUIZQXWAE-UWVGGRQHSA-N

Properties

• Density: 1.571g/cm³ (Cal.)
• Boiling point: 887.753°C at 760 mmHg (Cal.)
• Flash point: 490.695°C (Cal.)