CID 10959909

2-acetamido-4-o-(2-amino-2-deoxy-beta-d-glucopyranosyl)-2-deoxy-d-glucose

Structural Information

Molecular Formula
C14H26N2O10
SMILES
CC(=O)N[C@@H]1[C@H]([C@@H]([C@H](OC1O)CO)O[C@H]2[C@@H]([C@H]([C@@H]([C@H](O2)CO)O)O)N)O
InChI
InChI=1S/C14H26N2O10/c1-4(19)16-8-11(22)12(6(3-18)24-13(8)23)26-14-7(15)10(21)9(20)5(2-17)25-14/h5-14,17-18,20-23H,2-3,15H2,1H3,(H,16,19)/t5-,6-,7-,8-,9-,10-,11-,12-,13?,14+/m1/s1
InChIKey
TVLSMEPJGATPGK-UEVOBBHASA-N
Compound name
N-[(3R,4R,5S,6R)-5-[(2S,3R,4R,5S,6R)-3-amino-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-2,4-dihydroxy-6-(hydroxymethyl)oxan-3-yl]acetamide
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

9
Patents

382.15875 Da
Monoisotopic Mass

-5.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 383.16603 186.7
[M+Na]+ 405.14797 189.2
[M+NH4]+ 400.19257 187.0
[M+K]+ 421.12191 192.0
[M-H]- 381.15147 186.2
[M+Na-2H]- 403.13342 180.7
[M]+ 382.15820 185.8
[M]- 382.15930 185.8
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