Analyte Name

N-((((1R)-2-(6-Amino-9H-purin-9-yl)-1-methylethoxy)methyl)phenoxyphosphinyl)-D-Alanine-1-methylethyl ester (mix of diastereomers)

CAS Number

2053423-98-4

Molecular Formula

C21H29N6O5P

Molecular Weight

476.47

Accurate Mass

476.19

SMILES

NC1=C2C(N(C[C@H](OCP(OC3=CC=CC=C3)(N[C@H](C)C(OC(C)C)=O)=O)C)C=N2)=NC=N1

InChI

InChI=1S/C21H29N6O5P/c1-14(2)31-21(28)16(4)26-33(29,32-17-8-6-5-7-9-17)13-30-15(3)10-27-12-25-18-19(22)23-11-24-20(18)27/h5-9,11-12,14-16H,10,13H2,1-4H3,(H,26,29)(H2,22,23,24)/t15-,16-,33?/m1/s1

IUPAC

isopropyl (((((R)-1-(6-amino-9H-purin-9-yl)propan-2-yl)oxy)methyl)(phenoxy)phosphoryl)-D-alaninate

Country of Origin

CANADA

Product Format

Neat