5-hydroxy-CMP

Properties Image MNX_ID MNXM114601 reference metacycM:CPD-15158 formula C9H12N3O9P global charge -2 mol weight 337.181 InChIKey QONOHPMEMVHOPP-UAKXSSHOSA-L InChI InChI=1S/C9H14N3O9P/c10-7-3(13)1-12(9(16)11-7)8-6(15)5(14)4(21-8)2-20-22(17,18)19/h1,4-6,8,13-15H,2H2,(H2,10,11,16)(H2,17,18,19)/p-2/t4-,5-,6-,8-/m1/s1 SMILES NC1=NC(=O)N([C@@H]2O[C@H](COP(=O)([O-])[O-])[C@@H](O)[C@H]2O)C=C1O MNX internals InChI (mnx) InChI=1/C9H14N3O9P/c10-7-3(13)1-12(9(16)11-7)8-6(15)5(14)4(21-8)2-20-22(17,18)19/h1,4-6,8,13-15H,2H2,(H2,10,11,16)(H2,17,18,19)/t4-,5-,6-,8-/m1/s1 SMILES (mnx) [CH:1]1=[C:3]([OH:13])[C:7](=[NH:10])[N:11]=[C:9]([OH:16])[N:12]1[C@H:8]1[C@H:6]([OH:15])[C@H:5]([OH:14])[C@@H:4]([CH2:2][O:20][P:22]([OH:17])([OH:18])=[O:19])[O:21]1

Parent-child relations graph

Occurences in reactions #reac in my sandbox 0 in MNXref (generic) 1 in models (compartimentalized) 0