Alanyl-Lysine-Threonine

Properties Image MNX_ID MNXM744603 reference biggM:alalysthr formula C13H27N4O5 global charge 1 mol weight 319.382 InChIKey OINVDEKBKBCPLX-DOLQZWNJSA-O InChI InChI=1S/C13H26N4O5/c1-7(15)11(19)16-9(5-3-4-6-14)12(20)17-10(8(2)18)13(21)22/h7-10,18H,3-6,14-15H2,1-2H3,(H,16,19)(H,17,20)(H,21,22)/p+1/t7-,8-,9+,10-/m1/s1 SMILES C[C@@H](N)C(=O)N[C@@H](CCCC[NH3+])C(=O)N[C@@H](C(=O)O)[C@@H](C)O MNX internals InChI (mnx) InChI=1/C13H26N4O5/c1-7(15)11(19)16-9(5-3-4-6-14)12(20)17-10(8(2)18)13(21)22/h7-10,18H,3-6,14-15H2,1-2H3,(H,16,19)(H,17,20)(H,21,22)/t7-,8-,9+,10-/m1/s1 SMILES (mnx) [CH3:1][C@H:7]([C:11](=[N:16][C@@H:9]([CH2:5][CH2:3][CH2:4][CH2:6][NH2:14])[C:12](=[N:17][C@H:10]([C@@H:8]([CH3:2])[OH:18])[C:13](=[O:21])[OH:22])[OH:20])[OH:19])[NH2:15]

Parent-child relations graph

Occurences in reactions #reac in my sandbox 0 in MNXref (generic) 3 in models (compartimentalized) 3