adenylylcarboxyglycine residue

Properties Image MNX_ID MNXM145753 reference chebi:83151 formula C12H15N6O8P* global charge -1 mol weight   InChIKey   InChI   SMILES [*]NCC(=O)OP(=O)([O-])OC[C@H]1O[C@@H](N2C=NC3=C2N=CN=C3N)[C@H](O)[C@@H]1O MNX internals InChI (mnx) InChI=1/C13H19N6O8P/c1-15-2-7(20)27-28(23,24)25-3-6-9(21)10(22)13(26-6)19-5-18-8-11(14)16-4-17-12(8)19/h4-6,9-10,13,15,21-22H,2-3H2,1H3,(H,23,24)(H2,14,16,17)/t6-,9-,10-,13-/m1/s1/i1+1 SMILES (mnx) [13CH3:1][NH:15][CH2:2][C:7](=[O:20])[O:27][P:28]([OH:23])(=[O:24])[O:25][CH2:3][C@@H:6]1[C@@H:9]([OH:21])[C@@H:10]([OH:22])[C@H:13]([N:19]2[CH:5]=[N:18][C:8]3=[C:11]([NH2:14])[N:16]=[CH:4][N:17]=[C:12]32)[O:26]1

Parent-child relations graph

Occurences in reactions #reac in my sandbox 0 in MNXref (generic) 6 in models (compartimentalized) 0