Asn-Thr-Val

Properties Image MNX_ID MNXM1122760 reference chebi:160155 formula C13H24N4O6 global charge 0 mol weight 332.357 InChIKey BCADFFUQHIMQAA-KKHAAJSZSA-N InChI InChI=1S/C13H24N4O6/c1-5(2)9(13(22)23)16-12(21)10(6(3)18)17-11(20)7(14)4-8(15)19/h5-7,9-10,18H,4,14H2,1-3H3,(H2,15,19)(H,16,21)(H,17,20)(H,22,23)/t6-,7+,9+,10+/m1/s1 SMILES CC(C)[C@H](NC(=O)[C@@H](NC(=O)[C@@H](N)CC(N)=O)[C@@H](C)O)C(=O)O MNX internals InChI (mnx) InChI=1/C13H24N4O6/c1-5(2)9(13(22)23)16-12(21)10(6(3)18)17-11(20)7(14)4-8(15)19/h5-7,9-10,18H,4,14H2,1-3H3,(H2,15,19)(H,16,21)(H,17,20)(H,22,23)/t6-,7+,9+,10+/m1/s1 SMILES (mnx) [CH3:1][CH:5]([CH3:2])[C@@H:9]([C:13](=[O:22])[OH:23])[N:16]=[C:12]([C@H:10]([C@@H:6]([CH3:3])[OH:18])[N:17]=[C:11]([C@H:7]([CH2:4][C:8](=[NH:15])[OH:19])[NH2:14])[OH:20])[OH:21]

Parent-child relations graph

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