CID 15954437

2,6-diaminopurine arabinofuranoside

Structural Information

Molecular Formula
C10H14N6O4
SMILES
C1=NC2=NC(=NC(=C2N1[C@H]3[C@H]([C@@H]([C@H](O3)CO)O)O)N)N
InChI
InChI=1S/C10H14N6O4/c11-7-4-8(15-10(12)14-7)13-2-16(4)9-6(19)5(18)3(1-17)20-9/h2-3,5-6,9,17-19H,1H2,(H4,11,12,14,15)/t3-,5-,6+,9-/m1/s1
InChIKey
FJOPVJGCXAWFEC-FJFJXFQQSA-N
Compound name
(2R,3S,4S,5R)-2-(2,6-diaminopurin-7-yl)-5-(hydroxymethyl)oxolane-3,4-diol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

282.10767 Da
Monoisotopic Mass

-2.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 283.11495 161.3
[M+Na]+ 305.09689 171.5
[M-H]- 281.10039 162.2
[M+NH4]+ 300.14149 172.7
[M+K]+ 321.07083 168.1
[M+H-H2O]+ 265.10493 153.7
[M+HCOO]- 327.10587 177.7
[M+CH3COO]- 341.12152 171.7
[M+Na-2H]- 303.08234 162.2
[M]+ 282.10712 160.3
[M]- 282.10822 160.3
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

No patent data available for this compound.