CID 512285

Dznari

Structural Information

Molecular Formula
C11H14N4O3
SMILES
C1[C@H]([C@@H]([C@@H]([C@H]1O)O)O)N2C=NC3=C2C=CN=C3N
InChI
InChI=1S/C11H14N4O3/c12-11-8-5(1-2-13-11)15(4-14-8)6-3-7(16)10(18)9(6)17/h1-2,4,6-7,9-10,16-18H,3H2,(H2,12,13)/t6-,7+,9+,10-/m1/s1
InChIKey
HZZPYFOOVRPCIF-GOZTYBTRSA-N
Compound name
(1S,2R,3S,4R)-4-(4-aminoimidazo[4,5-c]pyridin-1-yl)cyclopentane-1,2,3-triol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

3
References

0
Patents

250.1066 Da
Monoisotopic Mass

-1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 251.11388 153.5
[M+Na]+ 273.09582 163.5
[M-H]- 249.09932 154.8
[M+NH4]+ 268.14042 169.3
[M+K]+ 289.06976 158.9
[M+H-H2O]+ 233.10386 146.5
[M+HCOO]- 295.10480 171.4
[M+CH3COO]- 309.12045 164.8
[M+Na-2H]- 271.08127 154.6
[M]+ 250.10605 151.5
[M]- 250.10715 151.5
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.