CID 73563

D-glucosaminic acid

Structural Information

Molecular Formula
C6H13NO6
SMILES
C([C@H]([C@H]([C@@H]([C@H](C(=O)O)N)O)O)O)O
InChI
InChI=1S/C6H13NO6/c7-3(6(12)13)5(11)4(10)2(9)1-8/h2-5,8-11H,1,7H2,(H,12,13)/t2-,3-,4-,5-/m1/s1
InChIKey
UFYKDFXCZBTLOO-TXICZTDVSA-N
Compound name
(2R,3R,4S,5R)-2-amino-3,4,5,6-tetrahydroxyhexanoic acid
Related CIDs

2D Structure

compound 2d structure
3
Annotation Hits

48
References

1490
Patents

195.07428 Da
Monoisotopic Mass

-5.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 196.08156 141.6
[M+Na]+ 218.06350 144.2
[M+NH4]+ 213.10810 144.0
[M+K]+ 234.03744 146.7
[M-H]- 194.06700 134.9
[M+Na-2H]- 216.04895 138.0
[M]+ 195.07373 139.0
[M]- 195.07483 139.0
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

patents stripe