CID 135463029

2',3'-dideoxyguanosine

Structural Information

Molecular Formula
C10H13N5O3
SMILES
C1C[C@@H](O[C@@H]1CO)N2C=NC3=C2N=C(NC3=O)N
InChI
InChI=1S/C10H13N5O3/c11-10-13-8-7(9(17)14-10)12-4-15(8)6-2-1-5(3-16)18-6/h4-6,16H,1-3H2,(H3,11,13,14,17)/t5-,6+/m0/s1
InChIKey
OCLZPNCLRLDXJC-NTSWFWBYSA-N
Compound name
2-amino-9-[(2R,5S)-5-(hydroxymethyl)oxolan-2-yl]-1H-purin-6-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

60
References

4808
Patents

251.10184 Da
Monoisotopic Mass

-0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 252.10912 153.3
[M+Na]+ 274.09106 163.7
[M-H]- 250.09456 154.9
[M+NH4]+ 269.13566 166.7
[M+K]+ 290.06500 160.1
[M+H-H2O]+ 234.09910 145.2
[M+HCOO]- 296.10004 170.8
[M+CH3COO]- 310.11569 164.7
[M+Na-2H]- 272.07651 155.9
[M]+ 251.10129 152.6
[M]- 251.10239 152.6
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