Ile-Arg-Thr

Properties Image MNX_ID MNXM1120815 reference chebi:158199 formula C16H32N6O5 global charge 0 mol weight 388.469 InChIKey QTUSJASXLGLJSR-OSUNSFLBSA-N InChI InChI=1S/C16H32N6O5/c1-4-8(2)11(17)14(25)21-10(6-5-7-20-16(18)19)13(24)22-12(9(3)23)15(26)27/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](N)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@H](C(=O)O)[C@@H](C)O MNX internals InChI (mnx) InChI=1/C16H32N6O5/c1-4-8(2)11(17)14(25)21-10(6-5-7-20-16(18)19)13(24)22-12(9(3)23)15(26)27/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:11]([C:14](=[N:21][C@@H:10]([CH2:6][CH2:5][CH2:7][NH:20][C:16](=[NH:18])[NH2:19])[C:13](=[N:22][C@@H:12]([C@@H:9]([CH3:3])[OH:23])[C:15](=[O:26])[OH:27])[OH:24])[OH:25])[NH2:17]

Parent-child relations graph

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