Nucleosides & Nucleotides

Cas#: 2002-59-7        Compound CID:  1268107

Formula:  C₅H₄N₄OS        Molecular Weight: 168.18

IUPAC Name: 6-sulfanylidene-3,7-dihydropurin-2-one

SMILES: C1=NC2=C(N1)C(=S)NC(=O)N2

InChIKey: RJOXFJDOUQJOMQ-UHFFFAOYSA-N

InChI: InChI=1S/C5H4N4OS/c10-5-8-3-2(4(11)9-5)6-1-7-3/h1H,(H3,6,7,8,9,10,11)

Cas#: 3249-92-1        Compound CID:  135742139

Formula:  C₁₀H₁₁BaN₄O₈P·xH₂O        Molecular Weight: 483.52

IUPAC Name: barium(2+);[(2R,3S,4R,5R)-3,4-dihydroxy-5-(6-oxo-1H-purin-9-yl)oxolan-2-yl]methyl phosphate

SMILES: C1=NC2=C(C(=O)N1)N=CN2C3C(C(C(O3)COP(=O)([O-])[O-])O)O.[Ba+2]

InChIKey: XRBNGVUPCIBZIL-MCDZGGTQSA-L

InChI: InChI=1S/C10H13N4O8P.Ba/c15-6-4(1-21-23(18,19)20)22-10(7(6)16)14-3-13-5-8(14)11-2-12-9(5)17;/h2-4,6-7,10,15-16H,1H2,(H,11,12,17)(H2,18,19,20);/q;+2/p-2/t4-,6-,7-,10-;/m1./s1