3-benzyl-3,6 -bis(glutathione)- 6-(hydroxymethyl)-diketopiperazine

Properties Image Occurences in reactions MNX_ID MNXM147771 #reac in my sandbox 0 in MNXref (generic) 2 in models (compartimentalized) 0 formula C32H42N8O15S2 charge -2 mass 842.2222 reference metacycM:CPD-17046 InChIKey YJISLDWVIYDIOE-WGTGPSAHSA-L InChI InChI=1S/C32H44N8O15S2/c33-17(27(50)51)6-8-21(42)37-19(25(48)35-11-23(44)45)13-56-31(10-16-4-2-1-3-5-16)29(54)40-32(15-41,30(55)39-31)57-14-20(26(49)36-12-24(46)47)38-22(43)9-7-18(34)28(52)53/h1-5,17-20,41H,6-15,33-34H2,(H,35,48)(H,36,49)(H,37,42)(H,38,43)(H,39,55)(H,40,54)(H,44,45)(H,46,47)(H,50,51)(H,52,53)/p-2/t17-,18-,19-,20-,31+,32+/m0/s1 SMILES [NH3+][C@@H](CCC(=O)N[C@@H](CS[C@@]1(CO)NC(=O)[C@@](Cc2ccccc2)(SC[C@H](NC(=O)CC[C@H]([NH3+])C(=O)[O-])C(=O)NCC(=O)[O-])NC1=O)C(=O)NCC(=O)[O-])C(=O)[O-]

Parent-child relations graph

Deprecated MNXref IDs graph