Ala-Cys-Gln

Properties Image MNX_ID MNXM1120683 reference chebi:158064 formula C11H20N4O5S global charge 0 mol weight 320.371 InChIKey FRFDXQWNDZMREB-ACZMJKKPSA-N InChI InChI=1S/C11H20N4O5S/c1-5(12)9(17)15-7(4-21)10(18)14-6(11(19)20)2-3-8(13)16/h5-7,21H,2-4,12H2,1H3,(H2,13,16)(H,14,18)(H,15,17)(H,19,20)/t5-,6-,7-/m0/s1 SMILES C[C@H](N)C(=O)N[C@@H](CS)C(=O)N[C@@H](CCC(N)=O)C(=O)O MNX internals InChI (mnx) InChI=1/C11H20N4O5S/c1-5(12)9(17)15-7(4-21)10(18)14-6(11(19)20)2-3-8(13)16/h5-7,21H,2-4,12H2,1H3,(H2,13,16)(H,14,18)(H,15,17)(H,19,20)/t5-,6-,7-/m0/s1 SMILES (mnx) [CH3:1][C@@H:5]([C:9](=[N:15][C@@H:7]([CH2:4][SH:21])[C:10](=[N:14][C@@H:6]([CH2:2][CH2:3][C:8](=[NH:13])[OH:16])[C:11](=[O:19])[OH:20])[OH:18])[OH:17])[NH2:12]

Parent-child relations graph

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