N6-(3-methylbut-2-en-1-yl)-2-thioadenosine37 in tRNA

Properties Image MNX_ID MNXM164158 reference metacycM:CPD-15360 formula C15H19N5O10P2S*2 global charge -2 mol weight   InChIKey   InChI   SMILES [*]OP(=O)([O-])OC[C@H]1O[C@@H](N2C=NC3=C(NCC=C(C)C)N=C(S)N=C32)[C@H](O)[C@@H]1OP(=O)([O-])O[*] MNX internals InChI (mnx) InChI=1/C17H27N5O10P2S/c1-9(2)5-6-18-14-11-15(21-17(35)20-14)22(8-19-11)16-12(23)13(32-34(26,27)29-4)10(31-16)7-30-33(24,25)28-3/h5,8,10,12-13,16,23H,6-7H2,1-4H3,(H,24,25)(H,26,27)(H2,18,20,21,35)/t10-,12-,13-,16-/m1/s1/i3+1,4+1 SMILES (mnx) [CH3:1][C:9]([CH3:2])=[CH:5][CH2:6][NH:18][C:14]1=[N:20][C:17]([SH:35])=[N:21][C:15]2=[C:11]1[N:19]=[CH:8][N:22]2[C@H:16]1[C@H:12]([OH:23])[C@H:13]([O:32][P:34]([OH:26])(=[O:27])[O:29][13CH3:4])[C@@H:10]([CH2:7][O:30][P:33]([OH:24])(=[O:25])[O:28][13CH3:3])[O:31]1

Parent-child relations graph

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