CID 72200

2-aminoadenosine

Structural Information

Molecular Formula
C10H14N6O4
SMILES
C1=NC2=C(N=C(N=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)16(2-13-4)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
ZDTFMPXQUSBYRL-UUOKFMHZSA-N
Compound name
(2R,3R,4S,5R)-2-(2,6-diaminopurin-9-yl)-5-(hydroxymethyl)oxolane-3,4-diol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

37
References

10796
Patents

282.10767 Da
Monoisotopic Mass

-1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 283.114946 161.3
[M+Na]+ 305.096888 171.5
[M-H]- 281.100394 162.2
[M+NH4]+ 300.141493 172.7
[M+K]+ 321.070828 168.1
[M+H-H2O]+ 265.104930 153.7
[M+HCOO]- 327.105871 177.7
[M+CH3COO]- 341.121521 171.7
[M+Na-2H]- 303.082336 162.2
[M]+ 282.10712142 160.3
[M]- 282.10821858 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

No literature data available for this compound.

Patent stripe

No patent data available for this compound.