CAS 501-97-3|Desaminotyrosine

Introduction:Basic information about CAS 501-97-3|Desaminotyrosine, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
Common NameDesaminotyrosine
CAS Number501-97-3Molecular Weight166.174
Density1.3±0.1 g/cm3Boiling Point352.4±17.0 °C at 760 mmHg
Molecular FormulaC9H10O3Melting Point129-131 °C(lit.)
MSDSChineseUSAFlash Point181.1±17.4 °C
Symbol
GHS07
Signal WordWarning

Names

Namephloretic acid
SynonymMore Synonyms

Desaminotyrosine BiologicalActivity

DescriptionDesaminotyrosine is a microbially associated metabolite protecting from influenza through augmentation of type I interferon signaling.
Related CatalogSignaling Pathways >>Anti-infection >>Influenza VirusResearch Areas >>InfectionNatural Products >>Saccharides and Glycosides
Target

Human Endogenous Metabolite

In VivoWild-type mice produce nanomoles of Desaminotyrosine per gram of feces and have picomolar quantities of Desaminotyrosine in the serum. Desaminotyrosine (200 mM) treatment before influenza infection, protects from influenza by type I interferon (IFN) signaling, with no effect on weight loss or survival in mice with or without vancomycin, neomycin, ampicillin, and metronidazole (VNAM). Desaminotyrosine enhances type I IFN in macrophages via type I IFN amplification in mice[1].
Animal AdminMice[1] Indicated mice receive 200 mM Desaminotyrosine dissolved in Kool-Aid in the drinking water (control animals receive Kool-Aid alone). Indicated mice receive poly(IC) injections of 1 mg/kg for vancomycin, neomycin, ampicillin, and metronidazole (VNAM) treated mice or 5 mg/kg for all other mice intraperitoneally daily for 4 days, and then mice are scarified on day five at which time serum is collected[1].
References

[1]. Steed AL, et al. The microbial metabolite desaminotyrosine protects from influenza through type I interferon. Science. 2017 Aug 4;357(6350):498-502.

Chemical & Physical Properties

Density1.3±0.1 g/cm3
Boiling Point352.4±17.0 °C at 760 mmHg
Melting Point129-131 °C(lit.)
Molecular FormulaC9H10O3
Molecular Weight166.174
Flash Point181.1±17.4 °C
Exact Mass166.062988
PSA57.53000
LogP1.10
Vapour Pressure0.0±0.8 mmHg at 25°C
Index of Refraction1.580
InChIKeyNMHMNPHRMNGLLB-UHFFFAOYSA-N
SMILESO=C(O)CCc1ccc(O)cc1
Storage condition2-8°C
Water Solubilityslightly soluble

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
MW5342000
CHEMICAL NAME :
Hydrocinnamic acid, p-hydroxy-
CAS REGISTRY NUMBER :
501-97-3
BEILSTEIN REFERENCE NO. :
2209841
LAST UPDATED :
199612
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C9-H10-O3
MOLECULAR WEIGHT :
166.19
WISWESSER LINE NOTATION :
QV2R DQ

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intravenous
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
1809 mg/kg
TOXIC EFFECTS :
Sense Organs and Special Senses (Eye) - effect, not otherwise specified Behavioral - convulsions or effect on seizure threshold Lungs, Thorax, or Respiration - dyspnea
REFERENCE :
OYYAA2 Oyo Yakuri. Pharmacometrics. (Oyo Yakuri Kenkyukai, CPO Box 180, Sendai 980-91, Japan) V.1- 1967- Volume(issue)/page/year: 12,265,1976

Safety Information

Symbol
GHS07
Signal WordWarning
Hazard StatementsH315-H319-H335
Precautionary StatementsP261-P305 + P351 + P338
Personal Protective Equipmentdust mask type N95 (US);Eyeshields;Gloves
Hazard CodesXi:Irritant
Risk PhrasesR36/37/38
Safety PhrasesS26-S36-S37/39
RIDADRNONH for all modes of transport
WGK Germany3
RTECSMW5342000
HS Code2916399090

Customs

HS Code2918290000
SummaryHS: 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%

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Synonyms

Benzenepropanoic acid, 4-hydroxy-
4-hydroxy-benzenepropanoic acid
MFCD00002778
3-(p-hydroxyphenyl)propionic acid
4-Hydroxyhydrocinnamic Acid
3-(4-Hydroxyphenyl)propanoic acid
Phloretic acid
3-(p-Hydroxyphenyl)propionic acid,Phloretic acid
3-(para-Hydroxyphenyl)propionic acid
3-(4-Hydroxyphenyl)-propionic acid
3-(4-Hydroxyphenyl)propionic acid
b-(p-Hydroxyphenyl)propionic acid
p-hydroxy-hydrocinnamic acid
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