2,3,5-(Triglutathion-S-Yl)Hydroquinone
[CAS# 119212-33-8]

Identification

• Name: 2,3,5-(Triglutathion-S-Yl)Hydroquinone
• Synonyms: (2S)-2-Amino-5-[[(1S)-1-[2,5-Bis[(1S)-1-[[(4S)-4-Amino-5-Hydroxy-5-Oxo-Pentanoyl]Amino]-2-(Carboxymethylamino)-2-Oxo-1-(Sulfanylmethyl)Ethyl]-3,6-Dihydroxy-Phenyl]-2-(Carboxymethylamino)-2-Oxo-1-(Sulfanylmethyl)Ethyl]Amino]-5-Oxo-Pentanoic Acid; (2S)-2-Amino-5-[[(1S)-1-[2,5-Bis[(1S)-1-[[(4S)-4-Amino-5-Hydroxy-1,5-Dioxopentyl]Amino]-2-(Carboxymethylamino)-1-(Mercaptomethyl)-2-Oxoethyl]-3,6-Dihydroxyphenyl]-2-(Carboxymethylamino)-1-(Mercaptomethyl)-2-Oxoethyl]Amino]-5-Oxopentanoic Acid; (2S)-2-Amino-5-[[(1S)-1-[2,5-Bis[(1S)-1-[[(4S)-4-Amino-5-Hydroxy-5-Keto-Pentanoyl]Amino]-2-(Carboxymethylamino)-2-Keto-1-(Mercaptomethyl)Ethyl]-3,6-Dihydroxy-Phenyl]-2-(Carboxymethylamino)-2-Keto-1-(Mercaptomethyl)Ethyl]Amino]-5-Keto-Valeric Acid
• Molecular Formula: C₃₆H₅₁N₉O₂₀S₃
• Molecular Weight: 1026.03
• CAS Registry Number: 119212-33-8
• SMILES: [C@@](NC(=O)CC[C@H](N)C(=O)O)(C1=C([C@](NC(=O)CC[C@H](N)C(=O)O)(C(=O)NCC(=O)O)CS)C(=CC(=C1O)[C@](NC(=O)CC[C@H](N)C(=O)O)(C(=O)NCC(=O)O)CS)O)(C(=O)NCC(=O)O)CS
• InChI: 1S/C36H51N9O20S3/c37-15(28(57)58)1-4-19(47)43-34(11-66,31(63)40-8-22(50)51)14-7-18(46)25(35(12-67,32(64)41-9-23(52)53)44-20(48)5-2-16(38)29(59)60)26(27(14)56)36(13-68,33(65)42-10-24(54)55)45-21(49)6-3-17(39)30(61)62/h7,15-17,46,56,66-68H,1-6,8-13,37-39H2,(H,40,63)(H,41,64)(H,42,65)(H,43,47)(H,44,48)(H,45,49)(H,50,51)(H,52,53)(H,54,55)(H,57,58)(H,59,60)(H,61,62)/t15-,16-,17-,34-,35-,36-/m0/s1
• InChIKey: FIVGDBPKNWRGCL-RENARIQWSA-N