Thr-Arg-Ile

Properties Image MNX_ID MNXM1126252 reference chebi:163666 formula C16H32N6O5 global charge 0 mol weight 388.469 InChIKey MQBTXMPQNCGSSZ-OSUNSFLBSA-N InChI InChI=1S/C16H32N6O5/c1-4-8(2)12(15(26)27)22-13(24)10(6-5-7-20-16(18)19)21-14(25)11(17)9(3)23/h8-12,23H,4-7,17H2,1-3H3,(H,21,25)(H,22,24)(H,26,27)(H4,18,19,20)/t8-,9+,10-,11-,12-/m0/s1 SMILES CC[C@H](C)[C@H](NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@@H](N)[C@@H](C)O)C(=O)O MNX internals InChI (mnx) InChI=1/C16H32N6O5/c1-4-8(2)12(15(26)27)22-13(24)10(6-5-7-20-16(18)19)21-14(25)11(17)9(3)23/h8-12,23H,4-7,17H2,1-3H3,(H,21,25)(H,22,24)(H,26,27)(H4,18,19,20)/t8-,9+,10-,11-,12-/m0/s1 SMILES (mnx) [CH3:1][CH2:4][C@H:8]([CH3:2])[C@@H:12]([C:15](=[O:26])[OH:27])[N:22]=[C:13]([C@H:10]([CH2:6][CH2:5][CH2:7][NH:20][C:16](=[NH:18])[NH2:19])[N:21]=[C:14]([C@H:11]([C@@H:9]([CH3:3])[OH:23])[NH2:17])[OH:25])[OH:24]

Parent-child relations graph

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