CID 4473082

Gamma-hydroxyarginine

Structural Information

Molecular Formula

C₆H₁₄N₄O₃

SMILES

C(C(CN=C(N)N)O)C(C(=O)O)N

InChI

InChI=1S/C6H14N4O3/c7-4(5(12)13)1-3(11)2-10-6(8)9/h3-4,11H,1-2,7H2,(H,12,13)(H4,8,9,10)

InChIKey

OPCBKDJCJYBGTQ-UHFFFAOYSA-N

Compound name

2-amino-5-(diaminomethylideneamino)-4-hydroxypentanoic acid

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 4
References: 291
Patents: 190.1066 Da
Monoisotopic Mass: -5.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	191.11388	142.4
[M+Na]+	213.09582	145.3
[M-H]-	189.09932	139.7
[M+NH4]+	208.14042	158.5
[M+K]+	229.06976	145.6
[M+H-H2O]+	173.10386	135.6
[M+HCOO]-	235.10480	163.8
[M+CH3COO]-	249.12045	191.1
[M+Na-2H]-	211.08127	141.3
[M]+	190.10605	135.5
[M]-	190.10715	135.5

Literature stripe

literature stripe

Patent stripe

patents stripe