CID 3000338

Amino nucleoside

Structural Information

Molecular Formula
C11H17N3O4
SMILES
CC1=CN(C(=O)NC1=O)[C@H]2C[C@H]([C@@H](O2)[C@H](C)O)N
InChI
InChI=1S/C11H17N3O4/c1-5-4-14(11(17)13-10(5)16)8-3-7(12)9(18-8)6(2)15/h4,6-9,15H,3,12H2,1-2H3,(H,13,16,17)/t6-,7+,8+,9-/m0/s1
InChIKey
FAXNJWRNLCWHMW-KDXUFGMBSA-N
Compound name
1-[(2R,4R,5R)-4-amino-5-[(1S)-1-hydroxyethyl]oxolan-2-yl]-5-methylpyrimidine-2,4-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

255.1219 Da
Monoisotopic Mass

-0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 256.129176 157.0
[M+Na]+ 278.111118 165.6
[M-H]- 254.114624 159.7
[M+NH4]+ 273.155723 170.4
[M+K]+ 294.085058 163.0
[M+H-H2O]+ 238.119160 149.9
[M+HCOO]- 300.120101 174.2
[M+CH3COO]- 314.135751 192.9
[M+Na-2H]- 276.096566 156.6
[M]+ 255.12135142 155.0
[M]- 255.12244858 155.0
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

No patent data available for this compound.