Asparaginyl-Methionyl-Proline

Properties Image MNX_ID MNXM744640 reference biggM:asnmetpro formula C14H24N4O5S global charge 0 mol weight 360.436 InChIKey WCRQQIPFSXFIRN-ZDGBYWQASA-N InChI InChI=1S/C14H24N4O5S/c1-24-6-4-9(17-12(20)8(15)7-11(16)19)13(21)18-5-2-3-10(18)14(22)23/h8-10H,2-7,15H2,1H3,(H2,16,19)(H,17,20)(H,22,23)/t8-,9+,10?/m1/s1 SMILES CSCC[C@H](NC(=O)[C@H](N)CC(N)=O)C(=O)N1CCCC1C(=O)O MNX internals InChI (mnx) InChI=1/C14H24N4O5S/c1-24-6-4-9(17-12(20)8(15)7-11(16)19)13(21)18-5-2-3-10(18)14(22)23/h8-10H,2-7,15H2,1H3,(H2,16,19)(H,17,20)(H,22,23)/t8-,9+,10?/m1/s1 SMILES (mnx) [CH3:1][S:24][CH2:6][CH2:4][C@@H:9]([C:13]([N:18]1[CH2:5][CH2:2][CH2:3][CH:10]1[C:14](=[O:22])[OH:23])=[O:21])[N:17]=[C:12]([C@@H:8]([CH2:7][C:11](=[NH:16])[OH:19])[NH2:15])[OH:20]

Parent-child relations graph

Occurences in reactions #reac in my sandbox 0 in MNXref (generic) 3 in models (compartimentalized) 3