CID 91861897

Galf(b1-5)b-galf

Structural Information

Molecular Formula
C12H22O11
SMILES
C([C@H]([C@H]1[C@@H]([C@H]([C@@H](O1)O[C@H](CO)[C@H]2[C@@H]([C@H]([C@@H](O2)O)O)O)O)O)O)O
InChI
InChI=1S/C12H22O11/c13-1-3(15)9-6(17)8(19)12(23-9)21-4(2-14)10-5(16)7(18)11(20)22-10/h3-20H,1-2H2/t3-,4-,5-,6-,7-,8-,9+,10+,11-,12-/m1/s1
InChIKey
PUGHZUFESKUDNP-RYRYQYGESA-N
Compound name
(2R,3R,4R,5R)-5-[(1R)-1-[(2R,3R,4R,5S)-5-[(1R)-1,2-dihydroxyethyl]-3,4-dihydroxyoxolan-2-yl]oxy-2-hydroxyethyl]oxolane-2,3,4-triol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

342.1162 Da
Monoisotopic Mass

-4.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 343.12348 171.3
[M+Na]+ 365.10542 173.4
[M-H]- 341.10892 168.8
[M+NH4]+ 360.15002 179.7
[M+K]+ 381.07936 174.5
[M+H-H2O]+ 325.11346 167.4
[M+HCOO]- 387.11440 177.6
[M+CH3COO]- 401.13005 196.2
[M+Na-2H]- 363.09087 166.1
[M]+ 342.11565 169.4
[M]- 342.11675 169.4
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.