Alanyl-Arginyl-Cysteine

Properties Image MNX_ID MNXM744598 reference biggM:alaargcys formula C12H25N6O4S global charge 1 mol weight 349.437 InChIKey WRDANSJTFOHBPI-UHFFFAOYSA-O InChI InChI=1S/C12H24N6O4S/c1-6(13)9(19)17-7(3-2-4-16-12(14)15)10(20)18-8(5-23)11(21)22/h6-8,23H,2-5,13H2,1H3,(H,17,19)(H,18,20)(H,21,22)(H4,14,15,16)/p+1 SMILES CC([NH3+])C(=O)NC(CCCNC(N)=[NH2+])C(=O)NC(CS)C(=O)[O-] MNX internals InChI (mnx) InChI=1/C12H24N6O4S/c1-6(13)9(19)17-7(3-2-4-16-12(14)15)10(20)18-8(5-23)11(21)22/h6-8,23H,2-5,13H2,1H3,(H,17,19)(H,18,20)(H,21,22)(H4,14,15,16)/t6?,7?,8? SMILES (mnx) [CH3:1][CH:6]([C:9](=[N:17][CH:7]([CH2:3][CH2:2][CH2:4][NH:16][C:12](=[NH:14])[NH2:15])[C:10](=[N:18][CH:8]([CH2:5][SH:23])[C:11](=[O:21])[OH:22])[OH:20])[OH:19])[NH2:13]

Parent-child relations graph

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