Ile-Met-Met

Properties Image MNX_ID MNXM1121247 reference chebi:158634 formula C16H31N3O4S2 global charge 0 mol weight 393.575 InChIKey AYLAAGNJNVZDPY-CYDGBPFRSA-N InChI InChI=1S/C16H31N3O4S2/c1-5-10(2)13(17)15(21)18-11(6-8-24-3)14(20)19-12(16(22)23)7-9-25-4/h10-13H,5-9,17H2,1-4H3,(H,18,21)(H,19,20)(H,22,23)/t10-,11-,12-,13-/m0/s1 SMILES CC[C@H](C)[C@H](N)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CCSC)C(=O)O MNX internals InChI (mnx) InChI=1/C16H31N3O4S2/c1-5-10(2)13(17)15(21)18-11(6-8-24-3)14(20)19-12(16(22)23)7-9-25-4/h10-13H,5-9,17H2,1-4H3,(H,18,21)(H,19,20)(H,22,23)/t10-,11-,12-,13-/m0/s1 SMILES (mnx) [CH3:1][CH2:5][C@H:10]([CH3:2])[C@@H:13]([C:15](=[N:18][C@@H:11]([CH2:6][CH2:8][S:24][CH3:3])[C:14](=[N:19][C@@H:12]([CH2:7][CH2:9][S:25][CH3:4])[C:16](=[O:22])[OH:23])[OH:20])[OH:21])[NH2:17]

Parent-child relations graph

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