N(omega)-(ADP-D-ribosyl)-L-arginine residue

Properties Image MNX_ID MNXM726744 reference chebi:142554 formula C21H32N9O14P2*2 global charge -1 mol weight   InChIKey   InChI   SMILES [*]N[C@@H](CCCNC(=[NH2+])NC1O[C@H](COP(=O)([O-])OP(=O)([O-])OC[C@H]2O[C@@H](N3C=NC4=C3N=CN=C4N)[C@H](O)[C@@H]2O)[C@@H](O)[C@H]1O)C([*])=O MNX internals InChI (mnx) InChI=1/C23H39N9O14P2/c1-10(33)11(26-2)4-3-5-27-23(25)31-21-17(36)15(34)12(44-21)6-42-47(38,39)46-48(40,41)43-7-13-16(35)18(37)22(45-13)32-9-30-14-19(24)28-8-29-20(14)32/h8-9,11-13,15-18,21-22,26,34-37H,3-7H2,1-2H3,(H,38,39)(H,40,41)(H2,24,28,29)(H3,25,27,31)/t11-,12+,13+,15+,16+,17+,18+,21?,22+/m0/s1/i1+1,2+1 SMILES (mnx) [13CH3:1][C:10]([C@H:11]([CH2:4][CH2:3][CH2:5][NH:27][C:23](=[NH:25])[NH:31][CH:21]1[C@H:17]([OH:36])[C@H:15]([OH:34])[C@@H:12]([CH2:6][O:42][P:47]([OH:38])(=[O:39])[O:46][P:48]([OH:40])(=[O:41])[O:43][CH2:7][C@@H:13]2[C@@H:16]([OH:35])[C@@H:18]([OH:37])[C@H:22]([N:32]3[CH:9]=[N:30][C:14]4=[C:19]([NH2:24])[N:28]=[CH:8][N:29]=[C:20]43)[O:45]2)[O:44]1)[NH:26][13CH3:2])=[O:33]

Parent-child relations graph

Occurences in reactions #reac in my sandbox 0 in MNXref (generic) 5 in models (compartimentalized) 0