Basic information
- CAS
51528-59-7- Standard SMILES
O=C(COP(=O)(O)O)NO- InChIKey
BAXHHWZKQZIJID-UHFFFAOYSA-N- Molecular formula
- C2H6NO6P
- Average molar mass
- 171.05 g/mol
- Monoisotopic mass
- 170.99327391
Overview
Phosphoglycolohydroxamic acid is the hydroxamate of phosphoglycolic acid. It has a role as an EC 5.3.1.1 (triose-phosphate isomerase) inhibitor. It is a hydroxamic acid and an amidoalkyl phosphate. It is functionally related to a glycolic acid.
Names & identifiers
- Preferred name
- Phosphoglycolohydroxamic Acid
- IUPAC
- [2-(hydroxyamino)-2-oxoethyl] dihydrogen phosphate
- English name
- phosphoglycolohydroxamate
- Molecular formula
- C2H6NO6P
- Molecular weight
- 171.05
Names & synonyms
Phosphoglycolohydroxamic Acidphosphoglycolohydroxamate51528-59-72-(hydroxyamino)-2-oxoethyl dihydrogen phosphateAcetamide, N-hydroxy-2-(phosphonooxy)-J5JKF7VX5ACHEBI:28475DTXSID90199497RefChem:862008DTXCID20121988CHEMBL3716681tpw
Show more names
PGH1trd1ik4[2-(hydroxyamino)-2-oxoethyl] dihydrogen phosphateorb1745098SCHEMBL4309631N-Hydroxy-2-(phosphonooxy)acetamideBDBM50167777
Database identifiers
- CAS
51528-59-7- PubChem CID
- 4797
- DTXSID
DTXSID90199497- ChEMBL
CHEMBL371668- ChEBI
CHEBI:28475- UNII
- J5JKF7VX5A
- Nikkaji
- J931.600K
Properties
Computed structural properties
- XLogP
- -2.7
- Topological polar surface area
- 116 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 3
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 161
Experimental & physicochemical properties
DrugsPharmaceuticals -> Listed in ZINC15
Physicochemical properties
- Density
- 1.889 · 1.889±0.06 g/cm3(Predicted)
- pka
- 1.7 · 1.70±0.10(Predicted)
- form
- Oil
- color
- Colorless to off-white
Chemistry & industry
Applications
UsesPhosphoglycolohydroxamic acid is a potent aldolase and triose-phosphate isomerase inhibitor. Phosphoglycolohydroxamic acid can be used in the research of antibacterial and antifungal area[1][2].
Suppliers4 total
上海陶术生物科技股份有限公司13564774135 · [email protected]
TargetMol中国（陶术生物）15002134094 · [email protected]
江苏艾康生物医药研发有限公司025-58859352 18651614124 · [email protected]
广州优南科技有限公司020-82000279 18988941452 · [email protected]
Additional notes
DefinitionChEBI: The hydroxamate of phosphoglycolic acid.
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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