PHOSPHOENOLPYRUVIC ACID MONOPOTASSIUM SALT CAS#: 4265-07-0; 凯望编码 (ChemWhat Code): 38422

IdentificationPhysical DataSpectra
Route of Synthesis (ROS)Safety and HazardsOther Data

Identification

英文名PHOSPHOENOLPYRUVIC ACID MONOPOTASSIUM SALT
IUPAC Namepotassium;1-carboxyethenyl hydrogen phosphate
分子结构PHOSPHOENOLPYRUVIC-ACID-MONOPOTASSIUM-SALT-CAS-4265-07-0
CAS编号 4265-07-0
MDL NumberMFCD00044476
别名4265-07-0
Potassium 1-carboxyvinyl hydrogenphosphate
PHOSPHOENOLPYRUVIC ACID MONOPOTASSIUM SALT
Phospho(enol)pyruvic acid monopotassium salt
MFCD00044476
phosphoenolpyruvate potassium salt
2-Propenoic acid, 2-(phosphonooxy)-, monopotassium salt
potassium;1-carboxyethenyl hydrogen phosphate
PHOSPHOENOL PYRUVATE MONOPOTASSIUM SALT
PEP-K;Potassium phosphoenolpyruvate;2-Phosphonooxy-acrylic acid potassium salt
potassium 2-(hydrogen phosphonooxy)prop-2-enoic acid
PEP-K
Potassium hydrogen 2-(phosphonatooxy)acrylate
EINECS 224-247-0
Phosphoenolpyruvicacidmonopotassiumsalt
C3H4KO6P
SCHEMBL2399312
DTXSID8063381
2-Propenoic acid, 2-(phosphonooxy)-, potassium salt (1:1)
AKOS016003884
AKOS024307559
Phosphoenolpyruvate, monopotassium salt
GS-5446
PD017213
SY075611
DB-050951
Phosphoenol-pyruvate, PEP, monopotassium salt
EN300-263193
H10560
Phospho(enol)pyruvic acid monopotassium salt, 99%
potassium 2-(hydrogen phosphonatooxy)prop-2-enoic acid
Z2429425999
Phospho(enol)pyruvic acid monopotassium salt, >=97% (enzymatic)
分子式C3H4KO6P
分子量206.13
InChIInChI=1S/C3H5O6P.K/c1-2(3(4)5)9-10(6,7)8;/h1H2,(H,4,5)(H2,6,7,8);/q;+1/p-1
InChI KeySOSDSEAIODNVPX-UHFFFAOYSA-M
Isomeric SMILESC=C(C(=O)O)OP(=O)(O)[O-].[K+]

Physical Data

AppearanceWhite powder

Spectra

Description (NMR Spectroscopy)Nucleus (NMR Spectroscopy)Solvents (NMR Spectroscopy)Temperature (NMR Spectroscopy), °C
Spectrum1H
Chemical shifts31Pheavy water, water242.789
Chemical shifts1HD2O
Chemical shifts31PH2O

Route of Synthesis (ROS)

Route of Synthesis (ROS) of PHOSPHOENOLPYRUVIC ACID MONOPOTASSIUM SALT CAS 4265-07-0
Route of Synthesis (ROS) of PHOSPHOENOLPYRUVIC ACID MONOPOTASSIUM SALT CAS 4265-07-0
ConditionsYield
With pKAD50; adenosine 5′-triphosphate sodium salt; Flavin mononucleotide; sodium dithionite; magnesium sulfate In sodium hydroxide at 23℃; for 1h; pH=8.1;67%

Safety and Hazards

Pictogram(s)exclamation-mark
SignalWarning
GHS Hazard StatementsH315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]
H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]
Precautionary Statement CodesP261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501
(The corresponding statement to each P-code can be found at the GHS Classification page.)

Other Data

HS Code
StorageStore at 2~8°C for long time.
Shelf Life1 year
Market Price
Druglikeness
Lipinski rules component
分子量206.133
logP-1.296
HBA6
HBD2
Matching Lipinski Rules4
Veber rules component
Polar Surface Area (PSA)116.7
Rotatable Bond (RotB)3
Matching Veber Rules2
Use Pattern
Phosphoenol pyruvate monopotassium salt is used as a substrate in enzyme reactions, particularly in glycolysis. It is the monopotassium salt form of phosphoenolpyruvate (PEP) and is commonly employed in studies related to enzymes involved in carbohydrate metabolism, such as pyruvate kinase (PK).

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