CID 11079995

Myristoyl methyl glucamide

Structural Information

Molecular Formula
C21H43NO6
SMILES
CCCCCCCCCCCCCC(=O)N(C)C[C@@H]([C@H]([C@@H]([C@@H](CO)O)O)O)O
InChI
InChI=1S/C21H43NO6/c1-3-4-5-6-7-8-9-10-11-12-13-14-19(26)22(2)15-17(24)20(27)21(28)18(25)16-23/h17-18,20-21,23-25,27-28H,3-16H2,1-2H3/t17-,18+,20+,21+/m0/s1
InChIKey
GBMPATKVZSIKPO-UYWIDEMCSA-N
Compound name
N-methyl-N-[(2S,3R,4R,5R)-2,3,4,5,6-pentahydroxyhexyl]tetradecanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

436
Patents

405.30905 Da
Monoisotopic Mass

2.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 406.31633 204.4
[M+Na]+ 428.29827 220.6
[M+NH4]+ 423.34287 219.6
[M+K]+ 444.27221 217.0
[M-H]- 404.30177 213.7
[M+Na-2H]- 426.28372 198.0
[M]+ 405.30850 216.0
[M]- 405.30960 216.0
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