CID 25244905

(2r,3s,4r,5s)-2-(7-amino-2,3-dihydro-1h-pyrazolo[4,3-d]pyrimidin-3-yl)-5-(hydroxymethyl)oxolane-3,4-diol

Structural Information

Molecular Formula
C10H15N5O4
SMILES
C1=NC2=C(C(=N1)N)NNC2[C@@H]3[C@H]([C@H]([C@@H](O3)CO)O)O
InChI
InChI=1S/C10H15N5O4/c11-10-6-4(12-2-13-10)5(14-15-6)9-8(18)7(17)3(1-16)19-9/h2-3,5,7-9,14-18H,1H2,(H2,11,12,13)/t3-,5?,7-,8-,9+/m0/s1
InChIKey
SIVHFRZJFCASNV-JPWDWCJRSA-N
Compound name
(2R,3S,4R,5S)-2-(7-amino-2,3-dihydro-1H-pyrazolo[4,3-d]pyrimidin-3-yl)-5-(hydroxymethyl)oxolane-3,4-diol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

269.1124 Da
Monoisotopic Mass

-2.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 270.11968 160.1
[M+Na]+ 292.10162 167.0
[M+NH4]+ 287.14622 163.6
[M+K]+ 308.07556 170.1
[M-H]- 268.10512 159.0
[M+Na-2H]- 290.08707 158.7
[M]+ 269.11185 160.0
[M]- 269.11295 160.0
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.