CID 91971267

3-deoxy-5-o-phosphono-beta-d-ribofuranose

Structural Information

Molecular Formula
C5H11O7P
SMILES
C1[C@H](O[C@H]([C@@H]1O)O)COP(=O)(O)O
InChI
InChI=1S/C5H11O7P/c6-4-1-3(12-5(4)7)2-11-13(8,9)10/h3-7H,1-2H2,(H2,8,9,10)/t3-,4+,5+/m0/s1
InChIKey
OOLHLHJSMUTTHE-VPENINKCSA-N
Compound name
[(2S,4R,5R)-4,5-dihydroxyoxolan-2-yl]methyl dihydrogen phosphate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

214.02425 Da
Monoisotopic Mass

-2.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 215.03153 141.9
[M+Na]+ 237.01347 148.1
[M-H]- 213.01697 139.6
[M+NH4]+ 232.05807 158.6
[M+K]+ 252.98741 148.5
[M+H-H2O]+ 197.02151 135.7
[M+HCOO]- 259.02245 163.5
[M+CH3COO]- 273.03810 174.1
[M+Na-2H]- 234.99892 144.0
[M]+ 214.02370 142.1
[M]- 214.02480 142.1
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.