Met-Thr-Arg

Properties Image MNX_ID MNXM1123687 reference chebi:161089 formula C15H30N6O5S global charge 0 mol weight 406.509 InChIKey KSIPKXNIQOWMIC-RCWTZXSCSA-N InChI InChI=1S/C15H30N6O5S/c1-8(22)11(21-12(23)9(16)5-7-27-2)13(24)20-10(14(25)26)4-3-6-19-15(17)18/h8-11,22H,3-7,16H2,1-2H3,(H,20,24)(H,21,23)(H,25,26)(H4,17,18,19)/t8-,9+,10+,11+/m1/s1 SMILES CSCC[C@H](N)C(=O)N[C@H](C(=O)N[C@@H](CCCN=C(N)N)C(=O)O)[C@@H](C)O MNX internals InChI (mnx) InChI=1/C15H30N6O5S/c1-8(22)11(21-12(23)9(16)5-7-27-2)13(24)20-10(14(25)26)4-3-6-19-15(17)18/h8-11,22H,3-7,16H2,1-2H3,(H,20,24)(H,21,23)(H,25,26)(H4,17,18,19)/t8-,9+,10+,11+/m1/s1 SMILES (mnx) [CH3:1][C@H:8]([C@@H:11]([C:13](=[N:20][C@@H:10]([CH2:4][CH2:3][CH2:6][NH:19][C:15](=[NH:17])[NH2:18])[C:14](=[O:25])[OH:26])[OH:24])[N:21]=[C:12]([C@H:9]([CH2:5][CH2:7][S:27][CH3:2])[NH2:16])[OH:23])[OH:22]

Parent-child relations graph

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