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Chemical structure of N,S-Bis-Fmoc-glutathione

GA23220

N,S-Bis-Fmoc-glutathione

Also known as (4S)-5-[[(2R)-1-(carboxymethylamino)-3-(9H-fluoren-9-ylmethoxycarbonylsulfanyl)-1-oxopropan-2-yl]amino]-4-(9H-fluoren-9-ylmethoxycarbonylamino)-5-oxopentanoic acid

N,S-Bis-Fmoc-glutathione(DiFMOC-G) which has been synthesized and characterized is a very potent competitive inhibitor of mammalian glyoxalase II activity(K, =0·75 M, calfliver glyoxalase II)

ChemicalCAS149438-56-2MW751.81FormulaC40H37N3O10S
CAS number
149438-56-2
Molecular weight
751.81
Formula
C40H37N3O10S
Solubility
Soluble in DMSO
InChIKey
RASUYODSPFXBSK-HEVIKAOCSA-N
Catalogue number
GA23220
Brand
GLPBIO
Computed properties PubChem CID 102600850 · XLogP 5.2 · TPSA 223 Ų · H-bond donors 5
XLogP
5.2
TPSA
223 Ų
H-bond donors
5
H-bond acceptors
11
Rotatable bonds
18
Heavy atoms
54

SMILES C1=CC=C2C(=C1)C(C3=CC=CC=C32)COC(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CSC(=O)OCC4C5=CC=CC=C5C6=CC=CC=C46)C(=O)NCC(=O)O

Computed descriptors from PubChem (CID 102600850), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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