CID 131750774

Leucyl-gamma-glutamate

Structural Information

Molecular Formula
C11H21N3O4
SMILES
CC(C)CC(C(=O)NC(=O)CCC(C(=O)O)N)N
InChI
InChI=1S/C11H21N3O4/c1-6(2)5-8(13)10(16)14-9(15)4-3-7(12)11(17)18/h6-8H,3-5,12-13H2,1-2H3,(H,17,18)(H,14,15,16)
InChIKey
GSRPWCGECLOSNH-UHFFFAOYSA-N
Compound name
2-amino-5-[(2-amino-4-methylpentanoyl)amino]-5-oxopentanoic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

12
Patents

259.1532 Da
Monoisotopic Mass

-3.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 260.16048 164.3
[M+Na]+ 282.14242 165.8
[M-H]- 258.14592 161.5
[M+NH4]+ 277.18702 178.2
[M+K]+ 298.11636 166.4
[M+H-H2O]+ 242.15046 157.5
[M+HCOO]- 304.15140 182.2
[M+CH3COO]- 318.16705 203.7
[M+Na-2H]- 280.12787 159.1
[M]+ 259.15265 160.4
[M]- 259.15375 160.4
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