His-Pro-Ser

Properties Image MNX_ID MNXM1120535 reference chebi:157916 formula C14H21N5O5 global charge 0 mol weight 339.352 InChIKey YEKYGQZUBCRNGH-DCAQKATOSA-N InChI InChI=1S/C14H21N5O5/c15-9(4-8-5-16-7-17-8)13(22)19-3-1-2-11(19)12(21)18-10(6-20)14(23)24/h5,7,9-11,20H,1-4,6,15H2,(H,16,17)(H,18,21)(H,23,24)/t9-,10-,11-/m0/s1 SMILES N[C@@H](CC1=CN=CN1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CO)C(=O)O MNX internals InChI (mnx) InChI=1/C14H21N5O5/c15-9(4-8-5-16-7-17-8)13(22)19-3-1-2-11(19)12(21)18-10(6-20)14(23)24/h5,7,9-11,20H,1-4,6,15H2,(H,16,17)(H,18,21)(H,23,24)/t9-,10-,11-/m0/s1 SMILES (mnx) [CH2:1]1[CH2:2][C@@H:11]([C:12](=[N:18][C@@H:10]([CH2:6][OH:20])[C:14](=[O:23])[OH:24])[OH:21])[N:19]([C:13]([C@H:9]([CH2:4][C:8]2=[CH:5][N:16]=[CH:7][NH:17]2)[NH2:15])=[O:22])[CH2:3]1

Parent-child relations graph

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