Ala-Phe-Arg

Properties Image MNX_ID MNXM1121018 reference chebi:158405 formula C18H28N6O4 global charge 0 mol weight 392.46 InChIKey PEIBBAXIKUAYGN-UBHSHLNASA-N InChI InChI=1S/C18H28N6O4/c1-11(19)15(25)24-14(10-12-6-3-2-4-7-12)16(26)23-13(17(27)28)8-5-9-22-18(20)21/h2-4,6-7,11,13-14H,5,8-10,19H2,1H3,(H,23,26)(H,24,25)(H,27,28)(H4,20,21,22)/t11-,13-,14-/m0/s1 SMILES C[C@H](N)C(=O)N[C@@H](CC1=CC=CC=C1)C(=O)N[C@@H](CCCN=C(N)N)C(=O)O MNX internals InChI (mnx) InChI=1/C18H28N6O4/c1-11(19)15(25)24-14(10-12-6-3-2-4-7-12)16(26)23-13(17(27)28)8-5-9-22-18(20)21/h2-4,6-7,11,13-14H,5,8-10,19H2,1H3,(H,23,26)(H,24,25)(H,27,28)(H4,20,21,22)/t11-,13-,14-/m0/s1 SMILES (mnx) [CH3:1][C@@H:11]([C:15](=[N:24][C@@H:14]([CH2:10][C:12]1=[CH:6][CH:3]=[CH:2][CH:4]=[CH:7]1)[C:16](=[N:23][C@@H:13]([CH2:8][CH2:5][CH2:9][NH:22][C:18](=[NH:20])[NH2:21])[C:17](=[O:27])[OH:28])[OH:26])[OH:25])[NH2:19]

Parent-child relations graph

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