Ile-Thr-Asn

Properties Image MNX_ID MNXM1121384 reference chebi:158772 formula C14H26N4O6 global charge 0 mol weight 346.384 InChIKey SAEWJTCJQVZQNZ-IUKAMOBKSA-N InChI InChI=1S/C14H26N4O6/c1-4-6(2)10(16)12(21)18-11(7(3)19)13(22)17-8(14(23)24)5-9(15)20/h6-8,10-11,19H,4-5,16H2,1-3H3,(H2,15,20)(H,17,22)(H,18,21)(H,23,24)/t6-,7+,8-,10-,11-/m0/s1 SMILES CC[C@H](C)[C@H](N)C(=O)N[C@H](C(=O)N[C@@H](CC(N)=O)C(=O)O)[C@@H](C)O MNX internals InChI (mnx) InChI=1/C14H26N4O6/c1-4-6(2)10(16)12(21)18-11(7(3)19)13(22)17-8(14(23)24)5-9(15)20/h6-8,10-11,19H,4-5,16H2,1-3H3,(H2,15,20)(H,17,22)(H,18,21)(H,23,24)/t6-,7+,8-,10-,11-/m0/s1 SMILES (mnx) [CH3:1][CH2:4][C@H:6]([CH3:2])[C@@H:10]([C:12](=[N:18][C@@H:11]([C@@H:7]([CH3:3])[OH:19])[C:13](=[N:17][C@@H:8]([CH2:5][C:9](=[NH:15])[OH:20])[C:14](=[O:23])[OH:24])[OH:22])[OH:21])[NH2:16]

Parent-child relations graph

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