5-Amino-6--5-phosphoribosylaminouracil

Properties Image MNX_ID MNXM1368395 reference seedM:cpd00931 formula C9H13N4O9P global charge -2 mol weight 352.196 InChIKey HHKDAYBJPZYULV-ABEFGGPWSA-L InChI InChI=1S/C9H15N4O9P/c10-3-6(12-9(17)13-7(3)16)11-8-5(15)4(14)2(22-8)1-21-23(18,19)20/h2-5,8,14-15H,1,10H2,(H2,18,19,20)(H2,11,12,13,16,17)/p-2/t2-,3?,4-,5-,8-/m1/s1 SMILES NC1C(=O)NC(=O)N=C1N[C@@H]1O[C@H](COP(=O)([O-])[O-])[C@@H](O)[C@H]1O MNX internals InChI (mnx) InChI=1/C9H15N4O9P/c10-3-6(12-9(17)13-7(3)16)11-8-5(15)4(14)2(22-8)1-21-23(18,19)20/h2-5,8,14-15H,1,10H2,(H2,18,19,20)(H2,11,12,13,16,17)/t2-,3?,4-,5-,8-/m1/s1 SMILES (mnx) [CH2:1]([C@@H:2]1[C@@H:4]([OH:14])[C@@H:5]([OH:15])[C@H:8]([N:11]=[C:6]2[CH:3]([NH2:10])[C:7]([OH:16])=[N:13][C:9]([OH:17])=[N:12]2)[O:22]1)[O:21][P:23]([OH:18])([OH:19])=[O:20]

Parent-child relations graph

Occurences in reactions #reac in my sandbox 0 in MNXref (generic) 5 in models (compartimentalized) 2