His-Pro-Val

Properties Image MNX_ID MNXM1120543 reference chebi:157924 formula C16H25N5O4 global charge 0 mol weight 351.407 InChIKey FLXCRBXJRJSDHX-AVGNSLFASA-N InChI InChI=1S/C16H25N5O4/c1-9(2)13(16(24)25)20-14(22)12-4-3-5-21(12)15(23)11(17)6-10-7-18-8-19-10/h7-9,11-13H,3-6,17H2,1-2H3,(H,18,19)(H,20,22)(H,24,25)/t11-,12-,13-/m0/s1 SMILES CC(C)[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H](N)CC1=CN=CN1)C(=O)O MNX internals InChI (mnx) InChI=1/C16H25N5O4/c1-9(2)13(16(24)25)20-14(22)12-4-3-5-21(12)15(23)11(17)6-10-7-18-8-19-10/h7-9,11-13H,3-6,17H2,1-2H3,(H,18,19)(H,20,22)(H,24,25)/t11-,12-,13-/m0/s1 SMILES (mnx) [CH3:1][CH:9]([CH3:2])[C@@H:13]([C:16](=[O:24])[OH:25])[N:20]=[C:14]([C@@H:12]1[CH2:4][CH2:3][CH2:5][N:21]1[C:15]([C@H:11]([CH2:6][C:10]1=[CH:7][N:18]=[CH:8][NH:19]1)[NH2:17])=[O:23])[OH:22]

Parent-child relations graph

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