Glutathione ethyl ester

Properties Image MNX_ID MNXM169062 reference chebi:183921 formula C12H21N3O6S global charge 0 mol weight 335.382 InChIKey HMFDVPSBWOHOAP-YUMQZZPRSA-N InChI InChI=1S/C12H21N3O6S/c1-2-22-6-8(11(19)14-5-10(17)18)15-9(16)4-3-7(13)12(20)21/h7-8H,2-6,13H2,1H3,(H,14,19)(H,15,16)(H,17,18)(H,20,21)/t7-,8-/m0/s1 SMILES CCSC[C@H](NC(=O)CC[C@H](N)C(=O)O)C(=O)NCC(=O)O MNX internals InChI (mnx) InChI=1/C12H21N3O6S/c1-2-22-6-8(11(19)14-5-10(17)18)15-9(16)4-3-7(13)12(20)21/h7-8H,2-6,13H2,1H3,(H,14,19)(H,15,16)(H,17,18)(H,20,21)/t7-,8-/m0/s1 SMILES (mnx) [CH3:1][CH2:2][S:22][CH2:6][C@@H:8]([C:11](=[N:14][CH2:5][C:10](=[O:17])[OH:18])[OH:19])[N:15]=[C:9]([CH2:4][CH2:3][C@@H:7]([C:12](=[O:20])[OH:21])[NH2:13])[OH:16]

Parent-child relations graph

Occurences in reactions #reac in my sandbox 0 in MNXref (generic) 1 in models (compartimentalized) 0