Cys-His-Thr

Properties Image MNX_ID MNXM1124011 reference chebi:161413 formula C13H21N5O5S global charge 0 mol weight 359.408 InChIKey UQHYQYXOLIYNSR-CUJWVEQBSA-N InChI InChI=1S/C13H21N5O5S/c1-6(19)10(13(22)23)18-12(21)9(2-7-3-15-5-16-7)17-11(20)8(14)4-24/h3,5-6,8-10,19,24H,2,4,14H2,1H3,(H,15,16)(H,17,20)(H,18,21)(H,22,23)/t6-,8+,9+,10+/m1/s1 SMILES C[C@@H](O)[C@H](NC(=O)[C@H](CC1=CN=CN1)NC(=O)[C@@H](N)CS)C(=O)O MNX internals InChI (mnx) InChI=1/C13H21N5O5S/c1-6(19)10(13(22)23)18-12(21)9(2-7-3-15-5-16-7)17-11(20)8(14)4-24/h3,5-6,8-10,19,24H,2,4,14H2,1H3,(H,15,16)(H,17,20)(H,18,21)(H,22,23)/t6-,8+,9+,10+/m1/s1 SMILES (mnx) [CH3:1][C@H:6]([C@@H:10]([C:13](=[O:22])[OH:23])[N:18]=[C:12]([C@H:9]([CH2:2][C:7]1=[CH:3][N:15]=[CH:5][NH:16]1)[N:17]=[C:11]([C@H:8]([CH2:4][SH:24])[NH2:14])[OH:20])[OH:21])[OH:19]

Parent-child relations graph

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