Met-Leu-Glu

Properties Image MNX_ID MNXM168318 reference sabiorkM:28769 formula C16H29N3O6S global charge 0 mol weight 391.49 InChIKey HGAJNEWOUHDUMZ-UHFFFAOYSA-N InChI InChI=1S/C16H29N3O6S/c1-9(2)8-12(19-14(22)10(17)6-7-26-3)15(23)18-11(16(24)25)4-5-13(20)21/h9-12H,4-8,17H2,1-3H3,(H,18,23)(H,19,22)(H,20,21)(H,24,25) SMILES CSCCC(N)C(O)=NC(CC(C)C)C(O)=NC(CCC(=O)O)C(=O)O MNX internals InChI (mnx) InChI=1/C16H29N3O6S/c1-9(2)8-12(19-14(22)10(17)6-7-26-3)15(23)18-11(16(24)25)4-5-13(20)21/h9-12H,4-8,17H2,1-3H3,(H,18,23)(H,19,22)(H,20,21)(H,24,25)/t10?,11?,12? SMILES (mnx) [CH3:1][CH:9]([CH3:2])[CH2:8][CH:12]([C:15](=[N:18][CH:11]([CH2:4][CH2:5][C:13](=[O:20])[OH:21])[C:16](=[O:24])[OH:25])[OH:23])[N:19]=[C:14]([CH:10]([CH2:6][CH2:7][S:26][CH3:3])[NH2:17])[OH:22]

Parent-child relations graph

Occurences in reactions #reac in my sandbox 0 in MNXref (generic) 1 in models (compartimentalized) 0