Ile-Lys-Arg

Properties Image MNX_ID MNXM1121185 reference chebi:158572 formula C18H37N7O4 global charge 0 mol weight 415.539 InChIKey NZGTYCMLUGYMCV-XUXIUFHCSA-N InChI InChI=1S/C18H37N7O4/c1-3-11(2)14(20)16(27)24-12(7-4-5-9-19)15(26)25-13(17(28)29)8-6-10-23-18(21)22/h11-14H,3-10,19-20H2,1-2H3,(H,24,27)(H,25,26)(H,28,29)(H4,21,22,23)/t11-,12-,13-,14-/m0/s1 SMILES CC[C@H](C)[C@H](N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCN=C(N)N)C(=O)O MNX internals InChI (mnx) InChI=1/C18H37N7O4/c1-3-11(2)14(20)16(27)24-12(7-4-5-9-19)15(26)25-13(17(28)29)8-6-10-23-18(21)22/h11-14H,3-10,19-20H2,1-2H3,(H,24,27)(H,25,26)(H,28,29)(H4,21,22,23)/t11-,12-,13-,14-/m0/s1 SMILES (mnx) [CH3:1][CH2:3][C@H:11]([CH3:2])[C@@H:14]([C:16](=[N:24][C@@H:12]([CH2:7][CH2:4][CH2:5][CH2:9][NH2:19])[C:15](=[N:25][C@@H:13]([CH2:8][CH2:6][CH2:10][NH:23][C:18](=[NH:21])[NH2:22])[C:17](=[O:28])[OH:29])[OH:26])[OH:27])[NH2:20]

Parent-child relations graph

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