Analyte Name

Adentri

CAS Number

166374-48-7

Molecular Formula

C18H24N4O3

Molecular Weight

344.40816

Accurate Mass

344.1848

SMILES

CCCN1C2=C(C(N(C1=O)CCC)=O)NC([C@H]3[C@@]4([H])[C@@]5([H])[C@]([C@](C3)([H])C4)([H])O5)=N2

InChI

InChI=1S/C18H24N4O3/c1-3-5-21-16-12(17(23)22(6-4-2)18(21)24)19-15(20-16)11-8-9-7-10(11)14-13(9)25-14/h9-11,13-14H,3-8H2,1-2H3,(H,19,20)/t9-,10+,11-,13-,14+/m1/s1

IUPAC

8-[(1S,2R,4S,5S,6R)-3-oxatricyclo[3.2.1]octan-6-yl]-1,3-dipropyl-7H-purine-2,6-dione

Country of Origin

CANADA

Product Format

Neat