CID 10478431

Amiglumide

Structural Information

Molecular Formula
C26H36N2O4
SMILES
CCCCCN(CCCCC)C(=O)[C@@H](CCC(=O)O)NC(=O)C1=CC2=CC=CC=C2C=C1
InChI
InChI=1S/C26H36N2O4/c1-3-5-9-17-28(18-10-6-4-2)26(32)23(15-16-24(29)30)27-25(31)22-14-13-20-11-7-8-12-21(20)19-22/h7-8,11-14,19,23H,3-6,9-10,15-18H2,1-2H3,(H,27,31)(H,29,30)/t23-/m1/s1
InChIKey
LFMMKOQRKPJBIG-HSZRJFAPSA-N
Compound name
(4R)-5-(dipentylamino)-4-(naphthalene-2-carbonylamino)-5-oxopentanoic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

2
References

94
Patents

440.26752 Da
Monoisotopic Mass

5.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 441.27480 213.4
[M+Na]+ 463.25674 212.8
[M-H]- 439.26024 215.2
[M+NH4]+ 458.30134 222.1
[M+K]+ 479.23068 209.9
[M+H-H2O]+ 423.26478 204.0
[M+HCOO]- 485.26572 230.2
[M+CH3COO]- 499.28137 239.5
[M+Na-2H]- 461.24219 210.1
[M]+ 440.26697 217.1
[M]- 440.26807 217.1
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