Val-Thr-His

Properties Image MNX_ID MNXM1128339 reference chebi:166381 formula C15H25N5O5 global charge 0 mol weight 355.395 InChIKey TVGWMCTYUFBXAP-QTKMDUPCSA-N InChI InChI=1S/C15H25N5O5/c1-7(2)11(16)13(22)20-12(8(3)21)14(23)19-10(15(24)25)4-9-5-17-6-18-9/h5-8,10-12,21H,4,16H2,1-3H3,(H,17,18)(H,19,23)(H,20,22)(H,24,25)/t8-,10+,11+,12+/m1/s1 SMILES CC(C)[C@H](N)C(=O)N[C@H](C(=O)N[C@@H](CC1=CN=CN1)C(=O)O)[C@@H](C)O MNX internals InChI (mnx) InChI=1/C15H25N5O5/c1-7(2)11(16)13(22)20-12(8(3)21)14(23)19-10(15(24)25)4-9-5-17-6-18-9/h5-8,10-12,21H,4,16H2,1-3H3,(H,17,18)(H,19,23)(H,20,22)(H,24,25)/t8-,10+,11+,12+/m1/s1 SMILES (mnx) [CH3:1][CH:7]([CH3:2])[C@@H:11]([C:13](=[N:20][C@@H:12]([C@@H:8]([CH3:3])[OH:21])[C:14](=[N:19][C@@H:10]([CH2:4][C:9]1=[CH:5][N:17]=[CH:6][NH:18]1)[C:15](=[O:24])[OH:25])[OH:23])[OH:22])[NH2:16]

Parent-child relations graph

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