Phe-Thr-Val

Properties Image MNX_ID MNXM1124501 reference chebi:161905 formula C18H27N3O5 global charge 0 mol weight 365.43 InChIKey MSSXKZBDKZAHCX-UNQGMJICSA-N InChI InChI=1S/C18H27N3O5/c1-10(2)14(18(25)26)20-17(24)15(11(3)22)21-16(23)13(19)9-12-7-5-4-6-8-12/h4-8,10-11,13-15,22H,9,19H2,1-3H3,(H,20,24)(H,21,23)(H,25,26)/t11-,13+,14+,15+/m1/s1 SMILES CC(C)[C@H](NC(=O)[C@@H](NC(=O)[C@@H](N)CC1=CC=CC=C1)[C@@H](C)O)C(=O)O MNX internals InChI (mnx) InChI=1/C18H27N3O5/c1-10(2)14(18(25)26)20-17(24)15(11(3)22)21-16(23)13(19)9-12-7-5-4-6-8-12/h4-8,10-11,13-15,22H,9,19H2,1-3H3,(H,20,24)(H,21,23)(H,25,26)/t11-,13+,14+,15+/m1/s1 SMILES (mnx) [CH3:1][CH:10]([CH3:2])[C@@H:14]([C:18](=[O:25])[OH:26])[N:20]=[C:17]([C@H:15]([C@@H:11]([CH3:3])[OH:22])[N:21]=[C:16]([C@H:13]([CH2:9][C:12]1=[CH:7][CH:5]=[CH:4][CH:6]=[CH:8]1)[NH2:19])[OH:23])[OH:24]

Parent-child relations graph

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