CID 443710

Kanosamine 6-phosphate

Structural Information

Molecular Formula
C6H14NO8P
SMILES
C([C@@H]1[C@H]([C@@H]([C@H](C(O1)O)O)N)O)OP(=O)(O)O
InChI
InChI=1S/C6H14NO8P/c7-3-4(8)2(1-14-16(11,12)13)15-6(10)5(3)9/h2-6,8-10H,1,7H2,(H2,11,12,13)/t2-,3+,4-,5-,6?/m1/s1
InChIKey
FNLHPZUNSZDBLN-CBPJZXOFSA-N
Compound name
[(2R,3S,4S,5R)-4-amino-3,5,6-trihydroxyoxan-2-yl]methyl dihydrogen phosphate
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

3
Patents

259.04572 Da
Monoisotopic Mass

-6.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 260.052996 153.5
[M+Na]+ 282.034938 158.6
[M-H]- 258.038444 149.4
[M+NH4]+ 277.079543 165.5
[M+K]+ 298.008878 158.8
[M+H-H2O]+ 242.042980 146.1
[M+HCOO]- 304.043921 171.5
[M+CH3COO]- 318.059571 186.2
[M+Na-2H]- 280.020386 153.6
[M]+ 259.04517142 150.7
[M]- 259.04626858 150.7
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe