8-Bromoadenosine

Properties Image MNX_ID MNXM39273 reference chebi:2312 formula C10H12BrN5O4 global charge 0 mol weight 346.141 InChIKey VJUPMOPLUQHMLE-UUOKFMHZSA-N InChI InChI=1S/C10H12BrN5O4/c11-10-15-4-7(12)13-2-14-8(4)16(10)9-6(19)5(18)3(1-17)20-9/h2-3,5-6,9,17-19H,1H2,(H2,12,13,14)/t3-,5-,6-,9-/m1/s1 SMILES NC1=NC=NC2=C1N=C(Br)N2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O MNX internals InChI (mnx) InChI=1/C10H12BrN5O4/c11-10-15-4-7(12)13-2-14-8(4)16(10)9-6(19)5(18)3(1-17)20-9/h2-3,5-6,9,17-19H,1H2,(H2,12,13,14)/t3-,5-,6-,9-/m1/s1 SMILES (mnx) [CH2:1]([C@@H:3]1[C@@H:5]([OH:18])[C@@H:6]([OH:19])[C@H:9]([N:16]2[C:8]3=[N:14][CH:2]=[N:13][C:7]([NH2:12])=[C:4]3[N:15]=[C:10]2[Br:11])[O:20]1)[OH:17]

Parent-child relations graph

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