3-Indolepropionic acid

Modify Date: 2024-01-02 19:18:16

3-Indolepropionic acid structure	Common Name	3-Indolepropionic acid
	CAS Number	830-96-6	Molecular Weight	189.210
	Density	1.3±0.1 g/cm3	Boiling Point	417.6±20.0 °C at 760 mmHg
	Molecular Formula	C₁₁H₁₁NO₂	Melting Point	134-135 °C(lit.)
	MSDS	Chinese USA	Flash Point	206.4±21.8 °C

Use of 3-Indolepropionic acid

3-Indolepropionic acid is shown to be a powerful antioxidant and has potential in the treatment for Alzheimer’s disease.

Name	3-(1H-indol-3-yl)propanoic acid
Synonym	More Synonyms

Description	3-Indolepropionic acid is shown to be a powerful antioxidant and has potential in the treatment for Alzheimer’s disease.
Related Catalog	Natural Products >> Saccharides and Glycosides Research Areas >> Metabolic Disease Research Areas >> Neurological Disease
Target	Human Endogenous Metabolite
In Vitro	3-Indolepropionic acid is shown to be a powerful antioxidant and has potential in the treatment for Alzheimer’s disease[1]. 3-Indolepropionic acid is a more potent scavenger of hydroxyl radicals than melatonin. Similar to melatonin but unlike other antioxidants, 3-Indolepropionic acid scavenges radicals without subsequently generating reactive and pro-oxidant intermediate compounds[2]. It is also suggested that indolepropionic acid, a gut microbiota-produced metabolite, is a potential biomarker for the development of type 2 diabetes (T2D) that may mediate its protective effect by preservation of β-cell function[3].
References	[1]. Wikoff WR, et al. Metabolomics analysis reveals large effects of gut microflora on mammalian blood metabolites. Proc Natl Acad Sci U S A. 2009 Mar 10;106(10):3698-703. [2]. Reiter RJ, et al. Reactive oxygen intermediates, molecular damage, and aging. Relation to melatonin. Ann N Y Acad Sci. 1998 Nov 20;854:410-24. [3]. de Mello VDet al. Indolepropionic acid and novel lipid metabolites are associated with a lower risk of type 2 diabetes in the Finnish Diabetes Prevention Study. Sci Rep. 2017 Apr 11;7:46337. doi: 10.1038/srep46337.

Density	1.3±0.1 g/cm3
Boiling Point	417.6±20.0 °C at 760 mmHg
Melting Point	134-135 °C(lit.)
Molecular Formula	C₁₁H₁₁NO₂
Molecular Weight	189.210
Flash Point	206.4±21.8 °C
Exact Mass	189.078979
PSA	53.09000
LogP	1.76
Vapour density	2.1 (vs air)
Vapour Pressure	0.0±1.0 mmHg at 25°C
Index of Refraction	1.667
Storage condition	−20°C
Water Solubility	slightly soluble

3-Indolepropionic acid MSDS(Chinese)

CHEMICAL IDENTIFICATION

RTECS NUMBER :: NM1329000

CHEMICAL NAME :: 1H-Indole-3-propionic acid

CAS REGISTRY NUMBER :: 830-96-6

BEILSTEIN REFERENCE NO. :: 0147733

LAST UPDATED :: 199701

DATA ITEMS CITED :: 2

MOLECULAR FORMULA :: C11-H11-N-O2

MOLECULAR WEIGHT :: 189.23

WISWESSER LINE NOTATION :: T56 BMJ D2VQ

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :: LDLo - Lowest published lethal dose

ROUTE OF EXPOSURE :: Intraperitoneal

SPECIES OBSERVED :: Rodent - mouse

DOSE/DURATION :: 100 mg/kg

TOXIC EFFECTS :: Lungs, Thorax, or Respiration - chronic pulmonary edema Lungs, Thorax, or Respiration - dyspnea

REFERENCE :: PSEBAA Proceedings of the Society for Experimental Biology and Medicine. (Academic Press, Inc., 1 E. First St., Duluth, MN 55802) V.1- 1903/04- Volume(issue)/page/year: 34,138,1936

Personal Protective Equipment	Eyeshields;Gloves;type N95 (US);type P1 (EN143) respirator filter
Hazard Codes	Xi:Irritant;
Risk Phrases	R22;R36/37/38
Safety Phrases	S7-S16-S24/25-S26-S36/37-S37/39-S22
RIDADR	UN 1987 3/PG 3
WGK Germany	3
RTECS	NT8050000
HS Code	29339990

Precursor 9
CAS#:120-72-9 Indole CAS#:79-10-7 Acrylic acid CAS#:10184-98-2 diethyl 2-(1H-i... CAS#:4361-05-1 Propanedioic ac...
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DownStream 10
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CAS#:6245-89-2 (1H-Indol-3-yl)... CAS#:5814-93-7 IPAM

HS Code	2933990090
Summary	2933990090. heterocyclic compounds with nitrogen hetero-atom(s) only. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%

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QSAR study on permeability of hydrophobic compounds with artificial membranes.

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We previously reported a classical quantitative structure-activity relationship (QSAR) equation for permeability coefficients (P(app-pampa)) by parallel artificial membrane permeation assay (PAMPA) of...

Structural insight into the inhibition of human kynurenine aminotransferase I/glutamine transaminase K.

J. Med. Chem. 52 , 2786-93, (2009)

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3-Indolepropionic acid

MFCD00005660

1H-Indole-3-propanoic acid

3-(1H-Indol-3-yl)propanoic acid

b-(3-Indolyl)propionic acid

Indole-3-propionic acid

EINECS 212-600-1

3-(1H-Indol-3-yl)propionic acid

IPA

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3-Indolepropionic acid

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