CID 636367

Glucuronamide

Structural Information

Molecular Formula
C6H11NO6
SMILES
[C@@H]1([C@@H]([C@H](O[C@H]([C@@H]1O)O)C(=O)N)O)O
InChI
InChI=1S/C6H11NO6/c7-5(11)4-2(9)1(8)3(10)6(12)13-4/h1-4,6,8-10,12H,(H2,7,11)/t1-,2-,3+,4-,6+/m0/s1
InChIKey
VOIFKEWOFUNPBN-QIUUJYRFSA-N
Compound name
(2S,3S,4S,5R,6R)-3,4,5,6-tetrahydroxyoxane-2-carboxamide
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

18
References

643
Patents

193.05864 Da
Monoisotopic Mass

-3.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 194.06592 138.3
[M+Na]+ 216.04786 144.6
[M-H]- 192.05136 137.1
[M+NH4]+ 211.09246 153.4
[M+K]+ 232.02180 144.2
[M+H-H2O]+ 176.05590 133.4
[M+HCOO]- 238.05684 153.2
[M+CH3COO]- 252.07249 176.6
[M+Na-2H]- 214.03331 139.5
[M]+ 193.05809 133.2
[M]- 193.05919 133.2
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