Synonyms
N1,O2'-Dimethyladenosine; 1-Methyl-2'-O-methyladenosine; 2'-O-Methyl-1-methyladenosine; 1,2'-O-dimethyladenosine
IUPAC Name
(2R,3R,4R,5R)-2-(hydroxymethyl)-5-(6-imino-1-methyl-2,3-dihydropurin-9-yl)-4-methoxyoxolan-3-ol
Molecular Formula
C12H17N5O4
Canonical SMILES
CN1CNC2=C(C1=N)N=CN2C3C(C(C(O3)CO)O)OC
InChI
InChI=1S/C12H19N5O4/c1-16-4-15-11-7(10(16)13)14-5-17(11)12-9(20-2)8(19)6(3-18)21-12/h5-6,8-9,12-13,15,18-19H,3-4H2,1-2H3/t6-,8-,9-,12-/m1/s1
InChIKey
ABZGKVIDNBLRBI-WOUKDFQISA-N
Boiling Point
612.0±65.0 °C at 760 mmHg
Melting Point
>115 °C (dec.)
Density
1.69±0.1 g/cm3 (Predicted)
Solubility
Soluble in Aqueous Acid (Slightly), DMSO (Slightly), Methanol (Slightly)
Appearance
White to Off-White Solid
Storage
Store at 2-8 °C, under inert atmosphere
Related CAS
59867-24-2 (HI salt)