CID 6101690

Mannose 6-phosphate

Structural Information

Molecular Formula
C6H13O9P
SMILES
C([C@H]([C@H]([C@@H]([C@@H](C=O)O)O)O)O)OP(=O)(O)O
InChI
InChI=1S/C6H13O9P/c7-1-3(8)5(10)6(11)4(9)2-15-16(12,13)14/h1,3-6,8-11H,2H2,(H2,12,13,14)/t3-,4-,5-,6-/m1/s1
InChIKey
VFRROHXSMXFLSN-KVTDHHQDSA-N
Compound name
[(2R,3R,4S,5S)-2,3,4,5-tetrahydroxy-6-oxohexyl] dihydrogen phosphate
Related CIDs

2D Structure

compound 2d structure
8
Annotation Hits

3013
References

61568
Patents

260.02972 Da
Monoisotopic Mass

-4.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 261.036996 153.6
[M+Na]+ 283.018938 156.6
[M-H]- 259.022444 144.1
[M+NH4]+ 278.063543 154.0
[M+K]+ 298.992878 157.4
[M+H-H2O]+ 243.026980 146.7
[M+HCOO]- 305.027921 170.1
[M+CH3COO]- 319.043571 181.4
[M+Na-2H]- 281.004386 150.9
[M]+ 260.02917142 153.3
[M]- 260.03026858 153.3
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