CID 22723545

Gamma-glutamylcysteinylserine

Structural Information

Molecular Formula
C11H19N3O7S
SMILES
C(CC(=O)NC(CS)C(=O)NC(CO)C(=O)O)C(C(=O)O)N
InChI
InChI=1S/C11H19N3O7S/c12-5(10(18)19)1-2-8(16)13-7(4-22)9(17)14-6(3-15)11(20)21/h5-7,15,22H,1-4,12H2,(H,13,16)(H,14,17)(H,18,19)(H,20,21)
InChIKey
QWHVIVGONDEFNH-UHFFFAOYSA-N
Compound name
2-amino-5-[[1-[(1-carboxy-2-hydroxyethyl)amino]-1-oxo-3-sulfanylpropan-2-yl]amino]-5-oxopentanoic acid
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

2
Patents

337.09436 Da
Monoisotopic Mass

-5.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 338.10164 174.4
[M+Na]+ 360.08358 172.6
[M+NH4]+ 355.12818 200.1
[M+K]+ 376.05752 174.4
[M-H]- 336.08708 167.3
[M+Na-2H]- 358.06903 168.8
[M]+ 337.09381 171.1
[M]- 337.09491 171.1
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