Pro-Ala-Phe

Properties Image MNX_ID MNXM1124640 reference chebi:162045 formula C17H23N3O4 global charge 0 mol weight 333.388 InChIKey CQZNGNCAIXMAIQ-UBHSHLNASA-N InChI InChI=1S/C17H23N3O4/c1-11(19-16(22)13-8-5-9-18-13)15(21)20-14(17(23)24)10-12-6-3-2-4-7-12/h2-4,6-7,11,13-14,18H,5,8-10H2,1H3,(H,19,22)(H,20,21)(H,23,24)/t11-,13-,14-/m0/s1 SMILES C[C@H](NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CC1=CC=CC=C1)C(=O)O MNX internals InChI (mnx) InChI=1/C17H23N3O4/c1-11(19-16(22)13-8-5-9-18-13)15(21)20-14(17(23)24)10-12-6-3-2-4-7-12/h2-4,6-7,11,13-14,18H,5,8-10H2,1H3,(H,19,22)(H,20,21)(H,23,24)/t11-,13-,14-/m0/s1 SMILES (mnx) [CH3:1][C@@H:11]([C:15](=[N:20][C@@H:14]([CH2:10][C:12]1=[CH:6][CH:3]=[CH:2][CH:4]=[CH:7]1)[C:17](=[O:23])[OH:24])[OH:21])[N:19]=[C:16]([C@@H:13]1[CH2:8][CH2:5][CH2:9][NH:18]1)[OH:22]

Parent-child relations graph

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