5-(chloromercuri)cytidine

Properties Image MNX_ID MNXM37968 reference metacycM:CPD0-1711 formula C9H12ClHgN3O5 global charge 0 mol weight 478.254 InChIKey DEBWUFGKLVMZFT-WFIJOQBCSA-M InChI InChI=1S/C9H12N3O5.ClH.Hg/c10-5-1-2-12(9(16)11-5)8-7(15)6(14)4(3-13)17-8;;/h2,4,6-8,13-15H,3H2,(H2,10,11,16);1H;/q;;+1/p-1/t4-,6-,7-,8-;;/m1../s1 SMILES NC1=NC(=O)N([C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)C=C1[Hg]Cl MNX internals InChI (mnx) InChI=1/C9H12N3O5.ClH.Hg/c10-5-1-2-12(9(16)11-5)8-7(15)6(14)4(3-13)17-8;;/h2,4,6-8,13-15H,3H2,(H2,10,11,16);1H;/q;;+1/t4-,6-,7-,8-;;/m1../s1 SMILES (mnx) [C:1]1=[CH:2][N:12]([C@H:8]2[C@H:7]([OH:15])[C@H:6]([OH:14])[C@@H:4]([CH2:3][OH:13])[O:17]2)[C:9]([OH:16])=[N:11][C:5]1=[NH:10].[ClH:18].[Hg+:19]

Parent-child relations graph

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