CID 44307236

2-amino-4-hydroxy-5-phosphonopentanoate

Structural Information

Molecular Formula
C5H12NO6P
SMILES
C(C(CP(=O)(O)O)O)C(C(=O)O)N
InChI
InChI=1S/C5H12NO6P/c6-4(5(8)9)1-3(7)2-13(10,11)12/h3-4,7H,1-2,6H2,(H,8,9)(H2,10,11,12)
InChIKey
LNSLSAKROUFKEI-UHFFFAOYSA-N
Compound name
2-amino-4-hydroxy-5-phosphonopentanoic acid
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

1
References

0
Patents

213.04022 Da
Monoisotopic Mass

-5.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 214.04750 145.5
[M+Na]+ 236.02944 148.4
[M+NH4]+ 231.07404 147.6
[M+K]+ 252.00338 150.4
[M-H]- 212.03294 138.5
[M+Na-2H]- 234.01489 142.2
[M]+ 213.03967 142.9
[M]- 213.04077 142.9
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.