CID 453828

4'-azidouridine

Structural Information

Molecular Formula
C9H11N5O6
SMILES
C1=CN(C(=O)NC1=O)[C@H]2[C@@H]([C@@H]([C@](O2)(CO)N=[N+]=[N-])O)O
InChI
InChI=1S/C9H11N5O6/c10-13-12-9(3-15)6(18)5(17)7(20-9)14-2-1-4(16)11-8(14)19/h1-2,5-7,15,17-18H,3H2,(H,11,16,19)/t5-,6+,7-,9-/m1/s1
InChIKey
FHPJZSIIXUQGQE-JVZYCSMKSA-N
Compound name
1-[(2R,3R,4S,5R)-5-azido-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]pyrimidine-2,4-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

4
References

766
Patents

285.07092 Da
Monoisotopic Mass

-1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 286.07820 153.8
[M+Na]+ 308.06014 161.8
[M-H]- 284.06364 157.3
[M+NH4]+ 303.10474 166.6
[M+K]+ 324.03408 154.7
[M+H-H2O]+ 268.06818 151.2
[M+HCOO]- 330.06912 176.2
[M+CH3COO]- 344.08477 189.9
[M+Na-2H]- 306.04559 162.9
[M]+ 285.07037 150.3
[M]- 285.07147 150.3
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