CID 16750075

2-amino-2-deoxy-mannitol-6-phosphate

Structural Information

Molecular Formula
C6H16NO8P
SMILES
C([C@H]([C@H]([C@@H]([C@@H](COP(=O)(O)O)O)O)O)N)O
InChI
InChI=1S/C6H16NO8P/c7-3(1-8)5(10)6(11)4(9)2-15-16(12,13)14/h3-6,8-11H,1-2,7H2,(H2,12,13,14)/t3-,4-,5-,6-/m1/s1
InChIKey
LBNVXZROMBUNNQ-KVTDHHQDSA-N
Compound name
[(2R,3S,4R,5R)-5-amino-2,3,4,6-tetrahydroxyhexyl] dihydrogen phosphate
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

8
References

39
Patents

261.06134 Da
Monoisotopic Mass

-7.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 262.06862 155.9
[M+Na]+ 284.05056 156.2
[M+NH4]+ 279.09516 156.0
[M+K]+ 300.02450 160.6
[M-H]- 260.05406 146.8
[M+Na-2H]- 282.03601 150.1
[M]+ 261.06079 152.0
[M]- 261.06189 152.0
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.