CID 5317736

Gamma-l-glutamyl-l-valine

Structural Information

Molecular Formula
C10H18N2O5
SMILES
CC(C)C(C(=O)O)NC(=O)CCC(C(=O)O)N
InChI
InChI=1S/C10H18N2O5/c1-5(2)8(10(16)17)12-7(13)4-3-6(11)9(14)15/h5-6,8H,3-4,11H2,1-2H3,(H,12,13)(H,14,15)(H,16,17)
InChIKey
AQAKHZVPOOGUCK-UHFFFAOYSA-N
Compound name
2-amino-5-[(1-carboxy-2-methylpropyl)amino]-5-oxopentanoic acid
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

16
References

597
Patents

246.12157 Da
Monoisotopic Mass

-2.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 247.12885 157.9
[M+Na]+ 269.11079 160.2
[M-H]- 245.11429 154.3
[M+NH4]+ 264.15539 172.1
[M+K]+ 285.08473 160.8
[M+H-H2O]+ 229.11883 151.8
[M+HCOO]- 291.11977 174.5
[M+CH3COO]- 305.13542 196.4
[M+Na-2H]- 267.09624 153.7
[M]+ 246.12102 155.2
[M]- 246.12212 155.2
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