Ile-Asn-Cys

Properties Image MNX_ID MNXM1120830 reference chebi:158215 formula C13H24N4O5S global charge 0 mol weight 348.425 InChIKey RSDHVTMRXSABSV-GHCJXIJMSA-N InChI InChI=1S/C13H24N4O5S/c1-3-6(2)10(15)12(20)16-7(4-9(14)18)11(19)17-8(5-23)13(21)22/h6-8,10,23H,3-5,15H2,1-2H3,(H2,14,18)(H,16,20)(H,17,19)(H,21,22)/t6-,7-,8-,10-/m0/s1 SMILES CC[C@H](C)[C@H](N)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CS)C(=O)O MNX internals InChI (mnx) InChI=1/C13H24N4O5S/c1-3-6(2)10(15)12(20)16-7(4-9(14)18)11(19)17-8(5-23)13(21)22/h6-8,10,23H,3-5,15H2,1-2H3,(H2,14,18)(H,16,20)(H,17,19)(H,21,22)/t6-,7-,8-,10-/m0/s1 SMILES (mnx) [CH3:1][CH2:3][C@H:6]([CH3:2])[C@@H:10]([C:12](=[N:16][C@@H:7]([CH2:4][C:9](=[NH:14])[OH:18])[C:11](=[N:17][C@@H:8]([CH2:5][SH:23])[C:13](=[O:21])[OH:22])[OH:19])[OH:20])[NH2:15]

Parent-child relations graph

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