His-Val-Gln

Properties Image MNX_ID MNXM1120715 reference chebi:158096 formula C16H26N6O5 global charge 0 mol weight 382.421 InChIKey WSXNWASHQNSMRX-GVXVVHGQSA-N InChI InChI=1S/C16H26N6O5/c1-8(2)13(15(25)21-11(16(26)27)3-4-12(18)23)22-14(24)10(17)5-9-6-19-7-20-9/h6-8,10-11,13H,3-5,17H2,1-2H3,(H2,18,23)(H,19,20)(H,21,25)(H,22,24)(H,26,27)/t10-,11-,13-/m0/s1 SMILES CC(C)[C@H](NC(=O)[C@@H](N)CC1=CN=CN1)C(=O)N[C@@H](CCC(N)=O)C(=O)O MNX internals InChI (mnx) InChI=1/C16H26N6O5/c1-8(2)13(15(25)21-11(16(26)27)3-4-12(18)23)22-14(24)10(17)5-9-6-19-7-20-9/h6-8,10-11,13H,3-5,17H2,1-2H3,(H2,18,23)(H,19,20)(H,21,25)(H,22,24)(H,26,27)/t10-,11-,13-/m0/s1 SMILES (mnx) [CH3:1][CH:8]([CH3:2])[C@@H:13]([C:15](=[N:21][C@@H:11]([CH2:3][CH2:4][C:12](=[NH:18])[OH:23])[C:16](=[O:26])[OH:27])[OH:25])[N:22]=[C:14]([C@H:10]([CH2:5][C:9]1=[CH:6][N:19]=[CH:7][NH:20]1)[NH2:17])[OH:24]

Parent-child relations graph

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