His-Ser-Glu

Properties Image MNX_ID MNXM1120557 reference chebi:157938 formula C14H21N5O7 global charge 0 mol weight 371.35 InChIKey JMSONHOUHFDOJH-GUBZILKMSA-N InChI InChI=1S/C14H21N5O7/c15-8(3-7-4-16-6-17-7)12(23)19-10(5-20)13(24)18-9(14(25)26)1-2-11(21)22/h4,6,8-10,20H,1-3,5,15H2,(H,16,17)(H,18,24)(H,19,23)(H,21,22)(H,25,26)/t8-,9-,10-/m0/s1 SMILES N[C@@H](CC1=CN=CN1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(=O)O)C(=O)O MNX internals InChI (mnx) InChI=1/C14H21N5O7/c15-8(3-7-4-16-6-17-7)12(23)19-10(5-20)13(24)18-9(14(25)26)1-2-11(21)22/h4,6,8-10,20H,1-3,5,15H2,(H,16,17)(H,18,24)(H,19,23)(H,21,22)(H,25,26)/t8-,9-,10-/m0/s1 SMILES (mnx) [CH2:1]([CH2:2][C:11](=[O:21])[OH:22])[C@@H:9]([C:14](=[O:25])[OH:26])[N:18]=[C:13]([C@H:10]([CH2:5][OH:20])[N:19]=[C:12]([C@H:8]([CH2:3][C:7]1=[CH:4][N:16]=[CH:6][NH:17]1)[NH2:15])[OH:23])[OH:24]

Parent-child relations graph

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