3-(3-hydroxyphenyl)-3-hydroxypropionic acid

Names

[ Name ]:
3-(3-hydroxyphenyl)-3-hydroxypropionic acid

[Synonym ]:
3-(3-hydroxyphenyl)-3-hydroxypropanoic acid
Benzenepropanoic acid, β,3-dihydroxy-
3-(3-Hydroxyphenyl)-3-hydroxypropionic acid
benzenepropanoic acid,|A,3-dihydroxy
(+-)-3-hydroxy-3-(3-hydroxy-phenyl)-propionic acid
(+-)-3-Hydroxy-3-(3-hydroxy-phenyl)-propionsaeure
3-Hydroxy-3-(3-hydroxyphenyl)propanoic acid
HPHPA
mHPHA

Biological Activity

[Description]:

3-(3-Hydroxyphenyl)-3-hydroxypropanoic acid is an endogenous metabolite present in Urine that can be used for the research of Autism[1][2].

[Related Catalog]:

Research Areas >> Neurological Disease

[Target]

Microbial Metabolite

Human Endogenous Metabolite

[In Vitro]

Endogenous metabolites is defined as those that are annotated by Kyoto Encyclopedia of Genes and Genomes as substrates or products of the ~1900 metabolic enzymes encoded in our genome. It is clear in the body of literature that there are documented toxic properties for many of these metabolites[1].

[References]

[1]. Lee N, et al. Endogenous toxic metabolites and implications in cancer therapy. Oncogene. 2020 Aug;39(35):5709-5720.

[2]. Shaw W. Increased urinary excretion of a 3-(3-hydroxyphenyl)-3-hydroxypropionic acid (HPHPA), an abnormal phenylalanine metabolite of Clostridia spp. in the gastrointestinal tract, in urine samples from patients with autism and schizophrenia. Nutr Neurosci. 2010 Jun;13(3):135-43.

Chemical & Physical Properties

[ Density]:
1.4±0.1 g/cm3

[ Boiling Point ]:
421.7±35.0 °C at 760 mmHg

[ Molecular Formula ]:
C₉H₁₀O₄

[ Molecular Weight ]:
182.173

[ Flash Point ]:
223.0±22.4 °C

[ Exact Mass ]:
182.057907

[ PSA ]:
77.76000

[ LogP ]:
-0.45

[ Vapour Pressure ]:
0.0±1.1 mmHg at 25°C

[ Index of Refraction ]:
1.615

Safety Information

[ HS Code ]:
2918290000

Synthetic Route

Click to get detail synthetic route

Precursor & DownStream

Precursor

DownStream

Customs

[ HS Code ]: 2918290000

[ Summary ]:
HS: 2918290000 other carboxylic acids with phenol function but without other oxygen function, their anhydrides, halides, peroxides, peroxyacids and their derivatives Tax rebate rate:9.0% Supervision conditions:AB(certificate of inspection for goods inward,certificate of inspection for goods outward) VAT:17.0% MFN tariff:6.5% General tariff:30.0%