CID 191372

2'-o-methyl-5-methyluridine

Structural Information

Molecular Formula
C11H16N2O6
SMILES
CC1=CN(C(=O)NC1=O)[C@H]2[C@@H]([C@@H]([C@H](O2)CO)O)OC
InChI
InChI=1S/C11H16N2O6/c1-5-3-13(11(17)12-9(5)16)10-8(18-2)7(15)6(4-14)19-10/h3,6-8,10,14-15H,4H2,1-2H3,(H,12,16,17)/t6-,7-,8-,10-/m1/s1
InChIKey
YHRRPHCORALGKQ-FDDDBJFASA-N
Compound name
1-[(2R,3R,4R,5R)-4-hydroxy-5-(hydroxymethyl)-3-methoxyoxolan-2-yl]-5-methylpyrimidine-2,4-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

3
References

3753
Patents

272.10083 Da
Monoisotopic Mass

-1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 273.10811 157.2
[M+Na]+ 295.09005 166.9
[M-H]- 271.09355 159.2
[M+NH4]+ 290.13465 169.8
[M+K]+ 311.06399 164.6
[M+H-H2O]+ 255.09809 150.4
[M+HCOO]- 317.09903 173.7
[M+CH3COO]- 331.11468 190.9
[M+Na-2H]- 293.07550 157.6
[M]+ 272.10028 158.8
[M]- 272.10138 158.8
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe