Met-Gln-Gln

Properties Image MNX_ID MNXM1123255 reference chebi:160655 formula C15H27N5O6S global charge 0 mol weight 405.477 InChIKey JYCQGAGDJQYEDB-GUBZILKMSA-N InChI InChI=1S/C15H27N5O6S/c1-27-7-6-8(16)13(23)19-9(2-4-11(17)21)14(24)20-10(15(25)26)3-5-12(18)22/h8-10H,2-7,16H2,1H3,(H2,17,21)(H2,18,22)(H,19,23)(H,20,24)(H,25,26)/t8-,9-,10-/m0/s1 SMILES CSCC[C@H](N)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(=O)O MNX internals InChI (mnx) InChI=1/C15H27N5O6S/c1-27-7-6-8(16)13(23)19-9(2-4-11(17)21)14(24)20-10(15(25)26)3-5-12(18)22/h8-10H,2-7,16H2,1H3,(H2,17,21)(H2,18,22)(H,19,23)(H,20,24)(H,25,26)/t8-,9-,10-/m0/s1 SMILES (mnx) [CH3:1][S:27][CH2:7][CH2:6][C@@H:8]([C:13](=[N:19][C@@H:9]([CH2:2][CH2:4][C:11](=[NH:17])[OH:21])[C:14](=[N:20][C@@H:10]([CH2:3][CH2:5][C:12](=[NH:18])[OH:22])[C:15](=[O:25])[OH:26])[OH:24])[OH:23])[NH2:16]

Parent-child relations graph

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