EU/US Properties Organoleptics Cosmetics Suppliers Safety Safety in use Safety references References Other Blenders Uses Occurrence Synonyms Articles Notes
 

5-caffeoyl quinic acid
3-[[3-(3,4-dihydroxyphenyl)-1-oxo-2-propenyl]oxy] 1,4,5-trihydroxycyclohexanecarboxylic acid

Supplier Sponsors

CAS Number: 906-33-2Picture of molecule3D/inchi
ECHA EINECS - REACH Pre-Reg:212-997-1
FDA UNII: O4601UER1Z
MDL:MFCD10566639
XlogP3-AA:-0.40 (est)
Molecular Weight:354.31226000
Formula:C16 H18 O9
NMR Predictor:Predict (works with chrome, Edge or firefox)
Category:natural substances and extractives
 
US / EU / FDA / JECFA / FEMA / FLAVIS / Scholar / Patent Information:
Google Scholar:Search
Google Books:Search
Google Scholar: with word "volatile"Search
Google Scholar: with word "flavor"Search
Google Scholar: with word "odor"Search
Google Patents:Search
US Patents:Search
EU Patents:Search
Pubchem Patents:Search
PubMed:Search
NCBI:Search
 
Physical Properties:
Assay: 95.00 to 100.00
Food Chemicals Codex Listed: No
Boiling Point: 664.95 °C. @ 760.00 mm Hg (est)
Flash Point: 474.00 °F. TCC ( 245.50 °C. ) (est)
logP (o/w): 0.370 (est)
Soluble in:
 water, 4.047e+005 mg/L @ 25 °C (est)
 
Organoleptic Properties:
Odor and/or flavor descriptions from others (if found).
 
Cosmetic Information:
None found
 
Suppliers:
Alfa Biotechnology
For experimental / research use only.
5-Caffeoylquinic acid/Neochlorogenic acid 98%
BOC Sciences
For experimental / research use only.
Neochlorogenic acid 98%
Odor: characteristic
Use: Neochlorogenic acid isolated from the flower of Lonicera japonica. anti-HIV; antiviral; antihepatotoxic;
Carbosynth
For experimental / research use only.
Neochlorogenic acid
Coompo
For experimental / research use only.
neoChlorogenic Acid from Plants ≥96%
Odor: characteristic
Use: Neochlorogenic acid may have potential as a chemopreventive dietary compound. Neochloroenic acid could be involved in the laxative effect observed in prunes. Antioxidative activities of the neochlorogenic acid, such as scavenging activity on superoxide anion radicals and inhibitory effect against oxidation of methyl linoleate, were also evaluated. Neochlorogenic acid inhibited the oxidation of LDL.
Dalton Pharma Services
For experimental / research use only.
5-Caffeoylquinic Acid
ExtraSynthese
For experimental / research use only.
Neochlorogenic acid (HPLC) ≥99%
Sigma-Aldrich: Sigma
For experimental / research use only.
Neochlorogenic acid ≥98.0% (HPLC)
sds
 
Safety Information:
Preferred SDS: View
 
Hazards identification
 
Classification of the substance or mixture
GHS Classification in accordance with 29 CFR 1910 (OSHA HCS)
None found.
GHS Label elements, including precautionary statements
 
Pictogram
 
Hazard statement(s)
None found.
Precautionary statement(s)
None found.
Oral/Parenteral Toxicity:
Not determined
Dermal Toxicity:
Not determined
Inhalation Toxicity:
Not determined
 
Safety in Use Information:
Category:
natural substances and extractives
Recommendation for 5-caffeoyl quinic acid usage levels up to:
 not for fragrance use.
 
Recommendation for 5-caffeoyl quinic acid flavor usage levels up to:
 not for flavor use.
 
Safety References:
EPI System: View
AIDS Citations:Search
Cancer Citations:Search
Toxicology Citations:Search
EPA ACToR:Toxicology Data
EPA Substance Registry Services (SRS):Registry
Laboratory Chemical Safety Summary :348159
National Institute of Allergy and Infectious Diseases:Data
WGK Germany:3
3-[3-(3,4-dihydroxyphenyl)prop-2-enoyloxy]-1,4,5-trihydroxycyclohexane-1-carboxylic acid
Chemidplus:0000906332
 
References:
 3-[3-(3,4-dihydroxyphenyl)prop-2-enoyloxy]-1,4,5-trihydroxycyclohexane-1-carboxylic acid
NIST Chemistry WebBook:Search Inchi
Pubchem (cid):348159
Pubchem (sid):135049021
 
Other Information:
(IUPAC):Atomic Weights of the Elements 2011 (pdf)
Videos:The Periodic Table of Videos
tgsc:Atomic Weights use for this web site
(IUPAC):Periodic Table of the Elements
CHEBI:View
KEGG (GenomeNet):C17147
HMDB (The Human Metabolome Database):Search
FooDB:FDB002562
VCF-Online:VCF Volatile Compounds in Food
ChemSpider:View
 
Potential Blenders and core components note
None Found
 
Potential Uses:
None Found
 
Occurrence (nature, food, other):note
 apple plant
Search Trop Picture
 apricot fruit
Search Trop Picture
 apricot seed
Search Trop Picture
 bilberry fruit
Search Trop Picture
 bilberry leaf
Search Trop Picture
 cabbage leaf
Search Trop Picture
 cherry sour cherry fruit
Search Trop Picture
 chicory root
Search Trop Picture
 chicory shoot
Search Trop Picture
 corn plant
Search Trop Picture
 currant black currant fruit
Search Trop Picture
 eggplant fruit
Search Trop Picture
 evening-primrose leaf
Search Trop Picture
 gooseberry fruit
Search Trop Picture
 grape fruit
Search Trop Picture
 lotus indian lotus root
Search Trop Picture
 plum fruit
Search Trop Picture
 pomegranate fruit
Search Trop Picture
 potato sweet potato root
Search Trop Picture
 potato tuber
Search Trop Picture
 quince fruit
Search Trop Picture
 rosemary plant
Search Trop Picture
 soybean shoot
Search Trop Picture
 spinach shoot
Search Trop Picture
 sunflower seed
Search Trop Picture
 tea leaf
Search Trop Picture
 tomato leaf
Search Trop Picture
 walnut english walnut leaf
Search Trop Picture
 
Synonyms:
5-caffeoylquinic acid
neochlorogenic acid
3-[[3-(3,4-dihydroxyphenyl)-1-oxo-2-propenyl]oxy] 1,4,5-trihydroxycyclohexanecarboxylic acid
3-[3-(3,4-dihydroxyphenyl)prop-2-enoyloxy]-1,4,5-trihydroxycyclohexane-1-carboxylic acid
 

Articles:

PubMed:Influence of the Stage of Ripeness on the Composition of Iridoids and Phenolic Compounds in Genipap (Genipa americana L.).
PubMed:Estimated dietary intake and major food sources of polyphenols in the Polish arm of the HAPIEE study.
PubMed:Effect of Chlorogenic Acid (5-Caffeoylquinic Acid) Isolated from Baccharis oxyodonta on the Structure and Pharmacological Activities of Secretory Phospholipase A2 from Crotalus durissus terrificus.
PubMed:Metabolomic fingerprinting of primed tobacco cells provide the first evidence for the biological origin of cis-chlorogenic acid.
PubMed:5-Caffeoylquinic acid decreases diet-induced obesity in rats by modulating PPARα and LXRα transcription.
PubMed:Precursor ion scan driven fast untargeted screening and semi-determination of caffeoylquinic acid derivatives in Cynara scolymus L.
PubMed:Isolation and identification of colourless caffeoyl compounds in purple sweet potato by HPLC-DAD-ESI/MS and their antioxidant activities.
PubMed:Decaffeinated green coffee bean extract attenuates diet-induced obesity and insulin resistance in mice.
PubMed:Coffee polyphenols improve peripheral endothelial function after glucose loading in healthy male adults.
PubMed:Inhibition of the β-Catenin/Tcf Signaling by Caffeoylquinic Acids in Sweet Potato Leaf through down Regulation of the Tcf-4 Transcription.
PubMed:Investigation of the in vivo antioxidative activity of Cynara scolymus (artichoke) leaf extract in the streptozotocin-induced diabetic rat.
PubMed:Sugar cane stillage: a potential source of natural antioxidants.
PubMed:Impact of chemical changes on the sensory characteristics of coffee beans during storage.
PubMed:Qualitative and quantitative analysis of phenolics in Tetrastigma hemsleyanum and their antioxidant and antiproliferative activities.
PubMed:A new method for the preparative isolation of chlorogenic acid lactones from coffee and model roasts of 5-caffeoylquinic acid.
PubMed:Development and validation of methods for the extraction of phenolic acids from plasma, urine, and liver and analysis by UPLC-MS.
PubMed:Biotransformation of caffeoyl quinic acids from green coffee extracts by Lactobacillus johnsonii NCC 533.
PubMed:Detection of a plant enzyme exhibiting chlorogenate-dependant caffeoyltransferase activity in methanolic extracts of arbuscular mycorrhizal tomato roots.
PubMed:Carotenoids and phenolic compounds from Solanum sessiliflorum, an unexploited Amazonian fruit, and their scavenging capacities against reactive oxygen and nitrogen species.
PubMed:Analysis of hydroxycinnamic acids derivatives in calafate (Berberis microphylla G. Forst) berries by liquid chromatography with photodiode array and mass spectrometry detection.
PubMed:Phenolic profile and antioxidant capacity of the principal apples produced in Brazil.
PubMed:Dietary intake and major food sources of polyphenols in a Spanish population at high cardiovascular risk: the PREDIMED study.
PubMed:Degradation kinetics of chlorogenic acid at various pH values and effects of ascorbic acid and epigallocatechin gallate on its stability under alkaline conditions.
PubMed:Qualitative and quantitative analysis of phenylpropanoids in cell culture, regenerated plantlets and herbs of Saussurea involucrata.
PubMed:Gastrointestinal absorption and metabolism of apple polyphenols ex vivo by the pig intestinal mucosa in the Ussing chamber.
PubMed:The type and concentration of milk increase the in vitro bioaccessibility of coffee chlorogenic acids.
PubMed:Coupling lipophilization and amylose complexation to encapsulate chlorogenic acid.
PubMed:Looking for the physiological role of anthocyanins in the leaves of Coffea arabica.
PubMed:Standardised herbal extract of chlorogenic acid from leaves of Etlingera elatior (Zingiberaceae).
PubMed:Phenolic composition and antioxidant activity of aqueous infusions from Capparis spinosa L. and Crithmum maritimum L. before and after submission to a two-step in vitro digestion model.
PubMed:Investigation of isomeric transformations of chlorogenic acid in buffers and biological matrixes by ultraperformance liquid chromatography coupled with hybrid quadrupole/ion mobility/orthogonal acceleration time-of-flight mass spectrometry.
PubMed:Rapid identification and evaluation of antioxidant compounds from extracts of Petasites japonicus by hyphenated-HPLC techniques.
PubMed:Chemical composition and antioxidant activity of yerba-mate (Ilex paraguariensis A.St.-Hil., Aquifoliaceae) extract as obtained by spray drying.
PubMed:Identification and characterization of two new derivatives of chlorogenic acids in Arnica (Arnica montana L.) flowers by high-performance liquid chromatography/tandem mass spectrometry.
PubMed:The antioxidant and chlorogenic acid profiles of whole coffee fruits are influenced by the extraction procedures.
PubMed:Colonic availability of polyphenols and D-(-)-quinic acid after apple smoothie consumption.
PubMed:Phenolic compounds of mountain tea from the Balkans: LC/DAD/ESI/MSn profile and content.
PubMed:Chemometric models for the quantitative descriptive sensory analysis of Arabica coffee beverages using near infrared spectroscopy.
PubMed:Intestinal transit and systemic metabolism of apple polyphenols.
PubMed:Profile and characterization of the chlorogenic acids in green Robusta coffee beans by LC-MS(n): identification of seven new classes of compounds.
PubMed:Hierarchical scheme for liquid chromatography/multi-stage spectrometric identification of 3,4,5-triacyl chlorogenic acids in green Robusta coffee beans.
PubMed:Polyphenols and phenolic acids from strawberry and apple decrease glucose uptake and transport by human intestinal Caco-2 cells.
PubMed:Novel hydroxycinnamoyl-coenzyme A quinate transferase genes from artichoke are involved in the synthesis of chlorogenic acid.
PubMed:Preparative separation of chlorogenic acid by centrifugal partition chromatography from highbush blueberry leaves (Vaccinium corymbosum L.).
PubMed:Kinetic analysis and mechanism on the inhibition of chlorogenic acid and its components against porcine pancreas alpha-amylase isozymes I and II.
PubMed:Influence of silicon on resistance of Zinnia elegans to Myzus persicae (Hemiptera: Aphididae).
PubMed:Antioxidative phenylpropanoid-substituted epicatechin glycosides from Parabarium huaitingii.
PubMed:Caffeic and chlorogenic acids in Ilex paraguariensis extracts are the main inhibitors of AGE generation by methylglyoxal in model proteins.
PubMed:Isolation and mapping of a C3'H gene (CYP98A49) from globe artichoke, and its expression upon UV-C stress.
PubMed:Chlorogenic acid protects paraoxonase 1 activity in high density lipoprotein from inactivation caused by physiological concentrations of hypochlorite.
PubMed:Salting-out gradients in centrifugal partition chromatography for the isolation of chlorogenic acids from green coffee beans.
PubMed:Caffeic acid derivatives from Eupatorium perfoliatum L.
PubMed:Activity of elaeochytrin A from Ferula elaeochytris on leukemia cell lines.
PubMed:5-Caffeoylquinic acid and caffeic acid orally administered suppress P-selectin expression on mouse platelets.
PubMed:Stress-induced biosynthesis of dicaffeoylquinic acids in globe artichoke.
PubMed:Quinic acid derivatives from Saussurea triangulata attenuates glutamate-induced neurotoxicity in primary cultured rat cortical cells.
PubMed:Low molecular weight melanoidins in coffee brew.
PubMed:5-caffeoylquinic acid and caffeic acid down-regulate the oxidative stress- and TNF-alpha-induced secretion of interleukin-8 from Caco-2 cells.
PubMed:Human glycemic response and phenolic content of unsweetened cranberry juice.
PubMed:Hydroxyhydroquinone interferes with the chlorogenic acid-induced restoration of endothelial function in spontaneously hypertensive rats.
PubMed:Profiling the phenolic compounds of Artemisia pectinata by HPLC-PAD-MSn.
PubMed:Abnormal accumulation of sugars and phenolics in tobacco roots expressing the Agrobacterium T-6b oncogene and the role of these compounds in 6b-induced growth.
PubMed:Phenol contents, oxidase activities, and the resistance of coffee to the leaf miner Leucoptera coffeella.
PubMed:Quantitation of volatiles and nonvolatile acids in an extract from coffee beverages: correlation with antioxidant activity.
PubMed:Characterization by LC-MS(n) of four new classes of p-coumaric acid-containing diacyl chlorogenic acids in green coffee beans.
PubMed:NMR metabolomics to revisit the tobacco mosaic virus infection in Nicotiana tabacum leaves.
PubMed:Chlorogenic acid attenuates hypertension and improves endothelial function in spontaneously hypertensive rats.
PubMed:Antioxidant and antiulcerative properties of phenolics from Chinese quince, quince, and apple fruits.
PubMed:Polyphenoloxidase activity in coffee leaves and its role in resistance against the coffee leaf miner and coffee leaf rust.
PubMed:A phenolic compound, 5-caffeoylquinic acid (chlorogenic acid), is a new type and strong matrix metalloproteinase-9 inhibitor: isolation and identification from methanol extract of Euonymus alatus.
PubMed:Discriminating between the six isomers of dicaffeoylquinic acid by LC-MS(n).
PubMed:Phenolic profile of hazelnut (Corylus avellana L.) leaves cultivars grown in Portugal.
PubMed:Phenolic profile, antioxidant property, and anti-influenza viral activity of Chinese quince (Pseudocydonia sinensis Schneid.), quince (Cydonia oblonga Mill.), and apple (Malus domestica Mill.) fruits.
PubMed:In vitro antioxidative effects and tyrosinase inhibitory activities of seven hydroxycinnamoyl derivatives in green coffee beans.
PubMed:LC-MS investigation of oxidation products of phenolic antioxidants.
PubMed:Profiling glucosinolates and phenolics in vegetative and reproductive tissues of the multi-purpose trees Moringa oleifera L. (horseradish tree) and Moringa stenopetala L.
PubMed:Quantitative changes in phenolic content during physiological development of the olive (Olea europaea) cultivar Hardy's Mammoth.
PubMed:Construction and application of a mass spectral and retention time index database generated from plant GC/EI-TOF-MS metabolite profiles.
PubMed:Green coffee bean extract and its metabolites have a hypotensive effect in spontaneously hypertensive rats.
PubMed:Metabolism of phenolic compounds during loquat fruit development.
PubMed:Absorption of chlorogenic acid and caffeic acid in rats after oral administration.
PubMed:Stabilization of soybean oil with heated quercetin and 5-caffeoylquinic acid in the presence of ferric ion.
PubMed:Phenolic antioxidants from the leaves of Corchorus olitorius L.
PubMed:Phytochemical and pharmacological studies of Guettarda acreana.
PubMed:Inhibition in vitro linoleic acid peroxidation and haemolysis by caffeoyltryptophan.
PubMed:Isolation and identification of compounds from Brazilian propolis which enhance macrophage spreading and mobility.
PubMed:Phenylpropanoid esters from Lamium album flowers.
PubMed:Developmental inhibition ofSpodoptera litura (Fab.) larvae by a novel caffeoylquinic acid from the wild groundnut,Arachis paraguariensis (Chod et Hassl.).
PubMed:[Hydroxycinnamic acid esters in brassicaceous vegetables and garden cress].
 
Notes:
None found
Please share your Comments.
Email Address:
Top of Page Home
Copyright © 1980-2021 The Good Scents Company (tgsc) ™ Disclaimer Privacy Policy