Thr-Ser-Met

Properties Image MNX_ID MNXM1126813 reference chebi:164229 formula C12H23N3O6S global charge 0 mol weight 337.398 InChIKey XZUBGOYOGDRYFC-XGEHTFHBSA-N InChI InChI=1S/C12H23N3O6S/c1-6(17)9(13)11(19)15-8(5-16)10(18)14-7(12(20)21)3-4-22-2/h6-9,16-17H,3-5,13H2,1-2H3,(H,14,18)(H,15,19)(H,20,21)/t6-,7+,8+,9+/m1/s1 SMILES CSCC[C@H](NC(=O)[C@H](CO)NC(=O)[C@@H](N)[C@@H](C)O)C(=O)O MNX internals InChI (mnx) InChI=1/C12H23N3O6S/c1-6(17)9(13)11(19)15-8(5-16)10(18)14-7(12(20)21)3-4-22-2/h6-9,16-17H,3-5,13H2,1-2H3,(H,14,18)(H,15,19)(H,20,21)/t6-,7+,8+,9+/m1/s1 SMILES (mnx) [CH3:1][C@H:6]([C@@H:9]([C:11](=[N:15][C@@H:8]([CH2:5][OH:16])[C:10](=[N:14][C@@H:7]([CH2:3][CH2:4][S:22][CH3:2])[C:12](=[O:20])[OH:21])[OH:18])[OH:19])[NH2:13])[OH:17]

Parent-child relations graph

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