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

11452
Patents

282.10767 Da
Monoisotopic Mass

-1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 283.11495 161.6
[M+Na]+ 305.09689 170.2
[M+NH4]+ 300.14149 165.3
[M+K]+ 321.07083 173.2
[M-H]- 281.10039 162.1
[M+Na-2H]- 303.08234 162.2
[M]+ 282.10712 162.3
[M]- 282.10822 162.3
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

patents stripe