Ketcher 01172011162D 1 1.00000 0.00000 0 20 19 0 1 0 999 V2000 12.5540 -26.6297 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.6879 -27.1297 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8220 -26.6296 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8220 -25.6295 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9560 -25.1295 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0899 -25.6295 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.9562 -24.1295 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.8222 -23.6294 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8222 -22.6294 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6881 -24.1296 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6881 -25.1296 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.5541 -23.6296 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 13.4202 -24.1296 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2863 -23.6296 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2863 -22.6296 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.1522 -24.1296 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.6880 -28.1296 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8219 -28.6296 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.5539 -28.6296 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.6881 -22.1294 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 2 1 1 6 0 0 2 3 1 0 0 0 2 17 1 0 0 0 3 4 1 0 0 0 4 5 1 0 0 0 5 6 2 0 0 0 5 7 1 0 0 0 7 8 1 0 0 0 8 9 1 1 0 0 8 10 1 0 0 0 9 20 1 0 0 0 10 11 2 0 0 0 10 12 1 0 0 0 12 13 1 0 0 0 13 14 1 0 0 0 14 15 2 0 0 0 14 16 1 0 0 0 17 18 2 0 0 0 17 19 1 0 0 0 M CHG 3 1 1 16 -1 19 -1 M END > CHEBI:57925 > glutathionate(1-) > A peptide anion obtained by deprotonation of both carboxy groups and protonation of the glutamyl amino group of glutathione; major species at pH 7.3. > 3 > glutathione; glutathionate ion; glutathionate anion; glutathionate > C10H16N3O6S > 306.310 > 306.07653 > -1 > [NH3+][C@@H](CCC(=O)N[C@@H](CS)C(=O)NCC(=O)[O-])C(=O)[O-] > InChI=1S/C10H17N3O6S/c11-5(10(18)19)1-2-7(14)13-6(4-20)9(17)12-3-8(15)16/h5-6,20H,1-4,11H2,(H,12,17)(H,13,14)(H,15,16)(H,18,19)/p-1/t5-,6-/m0/s1 > RWSXRVCMGQZWBV-WDSKDSINSA-M > 4200890; 4745654 $$$$