a 3-[(3S)-3-amino-3-carboxypropyl]-uridine47 in tRNAPhe

Properties Image MNX_ID MNXM148712 reference metacycM:3-N-3-carboxypropyl-uridine47-tRNAPhe formula C13H17N3O14P2*2 global charge -2 mol weight   InChIKey   InChI   SMILES [*]OP(=O)([O-])OC[C@H]1O[C@@H](N2C=CC(=O)N(CC[C@H]([NH3+])C(=O)[O-])C2=O)[C@H](O)[C@@H]1OP(=O)([O-])O[*] MNX internals InChI (mnx) InChI=1/C15H25N3O14P2/c1-28-33(24,25)30-7-9-12(32-34(26,27)29-2)11(20)13(31-9)18-6-4-10(19)17(15(18)23)5-3-8(16)14(21)22/h4,6,8-9,11-13,20H,3,5,7,16H2,1-2H3,(H,21,22)(H,24,25)(H,26,27)/t8-,9+,11+,12+,13+/m0/s1/i1+1,2+1 SMILES (mnx) [13CH3:1][O:28][P:33]([OH:24])(=[O:25])[O:30][CH2:7][C@@H:9]1[C@@H:12]([O:32][P:34]([OH:26])(=[O:27])[O:29][13CH3:2])[C@@H:11]([OH:20])[C@H:13]([N:18]2[CH:6]=[CH:4][C:10](=[O:19])[N:17]([CH2:5][CH2:3][C@@H:8]([C:14](=[O:21])[OH:22])[NH2:16])[C:15]2=[O:23])[O:31]1

Parent-child relations graph

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