CID 86095561

N2-(3-carboxy-2-hydroxy-1-oxopropyl)arginine

Structural Information

Molecular Formula
C10H18N4O6
SMILES
C(CC(C(=O)O)NC(=O)C(CC(=O)O)O)CN=C(N)N
InChI
InChI=1S/C10H18N4O6/c11-10(12)13-3-1-2-5(9(19)20)14-8(18)6(15)4-7(16)17/h5-6,15H,1-4H2,(H,14,18)(H,16,17)(H,19,20)(H4,11,12,13)
InChIKey
JRDIRZIEGSCMRP-UHFFFAOYSA-N
Compound name
2-[(3-carboxy-2-hydroxypropanoyl)amino]-5-(diaminomethylideneamino)pentanoic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

290.12262 Da
Monoisotopic Mass

-2.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 291.12990 165.5
[M+Na]+ 313.11184 164.6
[M+NH4]+ 308.15644 165.6
[M+K]+ 329.08578 167.4
[M-H]- 289.11534 159.8
[M+Na-2H]- 311.09729 160.8
[M]+ 290.12207 162.3
[M]- 290.12317 162.3
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

No patent data available for this compound.