Pro-His-Thr

Properties Image MNX_ID MNXM1124960 reference chebi:162369 formula C15H23N5O5 global charge 0 mol weight 353.379 InChIKey BODDREDDDRZUCF-QTKMDUPCSA-N InChI InChI=1S/C15H23N5O5/c1-8(21)12(15(24)25)20-14(23)11(5-9-6-16-7-18-9)19-13(22)10-3-2-4-17-10/h6-8,10-12,17,21H,2-5H2,1H3,(H,16,18)(H,19,22)(H,20,23)(H,24,25)/t8-,10+,11+,12+/m1/s1 SMILES C[C@@H](O)[C@H](NC(=O)[C@H](CC1=CN=CN1)NC(=O)[C@@H]1CCCN1)C(=O)O MNX internals InChI (mnx) InChI=1/C15H23N5O5/c1-8(21)12(15(24)25)20-14(23)11(5-9-6-16-7-18-9)19-13(22)10-3-2-4-17-10/h6-8,10-12,17,21H,2-5H2,1H3,(H,16,18)(H,19,22)(H,20,23)(H,24,25)/t8-,10+,11+,12+/m1/s1 SMILES (mnx) [CH3:1][C@H:8]([C@@H:12]([C:15](=[O:24])[OH:25])[N:20]=[C:14]([C@H:11]([CH2:5][C:9]1=[CH:6][N:16]=[CH:7][NH:18]1)[N:19]=[C:13]([C@@H:10]1[CH2:3][CH2:2][CH2:4][NH:17]1)[OH:22])[OH:23])[OH:21]

Parent-child relations graph

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