Isolecyl-Glycyl-Arginine

Properties Image MNX_ID MNXM744758 reference biggM:ileglyarg formula C14H29N6O4 global charge 1 mol weight 345.424 InChIKey NHJKZMDIMMTVCK-HOGWDWRMSA-O InChI InChI=1S/C14H28N6O4/c1-3-8(2)11(15)12(22)19-7-10(21)20-9(13(23)24)5-4-6-18-14(16)17/h8-9,11H,3-7,15H2,1-2H3,(H,19,22)(H,20,21)(H,23,24)(H4,16,17,18)/p+1/t8?,9-,11-/m1/s1 SMILES CCC(C)[C@@H](N)C(=O)NCC(=O)N[C@H](CCCNC(N)=[NH2+])C(=O)O MNX internals InChI (mnx) InChI=1/C14H28N6O4/c1-3-8(2)11(15)12(22)19-7-10(21)20-9(13(23)24)5-4-6-18-14(16)17/h8-9,11H,3-7,15H2,1-2H3,(H,19,22)(H,20,21)(H,23,24)(H4,16,17,18)/t8?,9-,11-/m1/s1 SMILES (mnx) [CH3:1][CH2:3][CH:8]([CH3:2])[C@H:11]([C:12](=[N:19][CH2:7][C:10](=[N:20][C@H:9]([CH2:5][CH2:4][CH2:6][NH:18][C:14](=[NH:16])[NH2:17])[C:13](=[O:23])[OH:24])[OH:21])[OH:22])[NH2:15]

Parent-child relations graph

Occurences in reactions #reac in my sandbox 0 in MNXref (generic) 3 in models (compartimentalized) 3