CID 440160

Beta-l-arabinose 1-phosphate

Structural Information

Molecular Formula
C5H11O8P
SMILES
C1[C@@H]([C@@H]([C@H]([C@H](O1)OP(=O)(O)O)O)O)O
InChI
InChI=1S/C5H11O8P/c6-2-1-12-5(4(8)3(2)7)13-14(9,10)11/h2-8H,1H2,(H2,9,10,11)/t2-,3-,4+,5+/m0/s1
InChIKey
ILXHFXFPPZGENN-QMKXCQHVSA-N
Compound name
[(2R,3R,4S,5S)-3,4,5-trihydroxyoxan-2-yl] dihydrogen phosphate
Related CIDs

2D Structure

compound 2d structure
3
Annotation Hits

4
References

81
Patents

230.01915 Da
Monoisotopic Mass

-3.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 231.02643 144.9
[M+Na]+ 253.00837 150.6
[M-H]- 229.01187 141.3
[M+NH4]+ 248.05297 158.5
[M+K]+ 268.98231 151.2
[M+H-H2O]+ 213.01641 138.2
[M+HCOO]- 275.01735 163.1
[M+CH3COO]- 289.03300 176.4
[M+Na-2H]- 250.99382 147.0
[M]+ 230.01860 143.3
[M]- 230.01970 143.3
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