caftaric acid (Q5017207)

caftaric acid (English)

(2S,3R)-cis-caftaric acid

14 October 2016

stereoisomer of

1 reference

(2S,3S)-2-[(E)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxy-3-hydroxybutanedioic acid

inferred from InChI

1 reference

(2S,3R)-trans-caftaric acid

inferred from InChI

1 reference

inferred from InChI

chemical formula

C₁₃H₁₂O₉

1 reference

caftaric acid (English)

14 October 2016

canonical SMILES

C1=CC(=C(C=C1C=CC(=O)OC(C(C(=O)O)O)C(=O)O)O)O

1 reference

caftaric acid (English)

14 October 2016

isomeric SMILES

C1=CC(=C(C=C1/C=C/C(=O)O[C@H]([C@H](C(=O)O)O)C(=O)O)O)O

1 reference

Caffeoyl conjugates from Echinacea species: Structures and biological activity

caftaric acid (English)

14 October 2016

4 references

Echinacea standardization: analytical methods for phenolic compounds and typical levels in medicinal species.

Phytochemical variation in echinacea from roots and flowerheads of wild and cultivated populations

Characterization of Antiviral Activities inEchinacea. Root Preparations

Echinacea angustifolia

3 references

Phytochemical variation within populations of Echinacea angustifolia (Asteraceae)

Echinacea standardization: analytical methods for phenolic compounds and typical levels in medicinal species.

Characterization of Antiviral Activities inEchinacea. Root Preparations

Echinacea atrorubens

1 reference

Phytochemical variation in echinacea from roots and flowerheads of wild and cultivated populations

Echinacea purpurea

7 references

Retention of caffeic acid derivatives in dried Echinacea purpurea

Echinacea standardization: analytical methods for phenolic compounds and typical levels in medicinal species.

Stabilization of caffeic acid derivatives in Echinacea purpurea L. glycerin extract

Cichoric Acid Content and Biomass Production ofEchinacea purpurea. Plants Cultivated in Slovenia

Characterization of Antiviral Activities inEchinacea. Root Preparations

HPLC ASSAY OF ECHINACEA PURPUREA/GOLDENSEAL (HYDRASTIS CANADENSIS) COMBINATION FORMULATIONS FOR PHENOLIC ACIDS, ALKYLAMIDES, AND ALKALOIDS

Evaluation of Major Caffeic Acid Derivatives inEchinacea purpureaDietary Supplements by HPLC with Photodiode Array Detection and Electrospray Mass Spectrometry

Hydrastis canadensis

1 reference

HPLC ASSAY OF ECHINACEA PURPUREA/GOLDENSEAL (HYDRASTIS CANADENSIS) COMBINATION FORMULATIONS FOR PHENOLIC ACIDS, ALKYLAMIDES, AND ALKALOIDS

Lapsana communis

1 reference

Caffeoyl Quinic and Tartaric Acids and Flavonoids from Lapsana communis L. subsp. communis (Asteraceae)

common dandelion

1 reference

Coumarins, caffeoyltartaric acids and their artifactual methyl esters from Taraxacum officinale leaves

Vitis vinifera

14 references

Polyphenolic composition of raisins

Extraction of Hydroxycinnamoyltartaric Acids from Berries of Different Grape Varieties

Phenolic composition of grape stems

Investigations on Anthocyanins in Wines from Vitis vinifera cv. Pinotage: Factors Influencing the Formation of Pinotin A and Its Correlation with Wine Age

Phenolics in White Free Run Juices and Wines from Penedès by High-Performance Liquid Chromatography: Changes during Vinification

Polyphenols content in some Italian red wines of different geographical origins

Relationship among antioxidant activity, vasodilation capacity, and phenolic content of red wines

The Phenolic Composition of South African Pinotage, Shiraz and Cabernet Sauvignon Wines

Wine phenolics: contribution to dietary intake and bioavailability

Resistance factors to grey mould in grape berries: identification of some phenolics inhibitors of Botrytis cinerea stilbene oxidase

Investigations on anthocyanins in wines from Vitis vinifera cv. pinotage: factors influencing the formation of pinotin A and its correlation with wine age.

Leaf removal and wine composition of Vitis vinifera L. cv. Nero d'Avola: the volatile aroma constituents.

Phenolic Compounds in White Grapes Grown in New York

Taraxacum platycarpum

1 reference

Characterization of phenolic acids and flavonoids in dandelion (Taraxacum officinale WEB. ex WIGG.) root and herb by high-performance liquid chromatography/electrospray ionization mass spectrometry

Cichorium intybus

1 reference

Phenolic profiles in leaves of chicory cultivars (Cichorium intybus L.) as influenced by organic and mineral fertilizers

Vitis aestivalis

1 reference

Vitis monticola

1 reference

Vitis arizonica

1 reference

Vitis labrusca

2 references

Phenolic Compounds in White Grapes Grown in New York

Vitis treleasei

1 reference

Vitis mustangensis

1 reference

Vitis girdiana

1 reference

Vitis shuttleworthii

1 reference

Vitis amurensis

1 reference

Vitis californica

1 reference

Vitis novae-angliae

1 reference

Vitis doniana

1 reference

Vitis cinerea

1 reference

Vitis acerifolia

1 reference

Vitis longii

1 reference

Vitis riparia

1 reference

Vitis rupestris

1 reference

Vitis cordifolia

1 reference

Vitis vulpina

1 reference

Vitis rotundifolia

1 reference

Vitis giradiana

1 reference

Vitis cinerea var. helleri

1 reference

Phaseolus vulgaris

1 reference

Alpha-amylase, α-glucosidase and lipase inhibiting activities of polyphenol-rich extracts from six common bean cultivars of Southern Italy, before and after cooking.

Aquarius grandiflorus

1 reference

Trans-Aconitic acid, glucosylflavones and hydroxycinnamoyltartaric acids from the leaves of Echinodorus grandiflorus ssp. aureus, a Brazilian medicinal plant

Identifiers

InChI

InChI=1S/C13H12O9/c14-7-3-1-6(5-8(7)15)2-4-9(16)22-11(13(20)21)10(17)12(18)19/h1-5,10-11,14-15,17H,(H,18,19)(H,20,21)/b4-2+/t10-,11-/m1/s1

1 reference

caftaric acid (English)

14 October 2016

1 reference

Global Substance Registration System

caftaric acid (English)

14 October 2016

2 references

UNII

WCV7W3174L

caftaric acid (English)

14 October 2016

https://commonchemistry.cas.org/detail?cas_rn=67879-58-7

8 April 2021

1 reference

Caftaric acid (English)

14 October 2016

2 references

caftaric acid (English)

14 October 2016

ChEBI ID

174975

mapping relation type

exact match

2 references

ChEBI release 2022-06-13

International Chemical Identifier

InChI

InChI=1S/C13H12O9/c14-7-3-1-6(5-8(7)15)2-4-9(16)22-11(13(20)21)10(17)12(18)19/h1-5,10-11,14-15,17H,(H,18,19)(H,20,21)/b4-2+/t10-,11-/m1/s1

1 reference

Mapping file of InChIStrings, InChIKeys and DTXSIDs for the EPA CompTox Dashboard

CAFTARIC ACID (English)

14 October 2016

1 reference

2 references

DSSTOX compound identifier

0 references

1 reference

ECHA Substance Infocard database

ECHA Substance Infocard ID

100.107.739

27 December 2018

ECHA Substance Infocard ID

Butanedioic acid, 2-[[(2E)-3-(3,4-dihydroxyphenyl)-1-oxo-2-propen-1-yl]oxy]-3-hydroxy-, (2R,3R)- (English)

quotation

CAS no.: 67879-58-7 (English)

100.107.739

1 reference

ECHA Substance Infocard database

ECHA Substance Infocard ID

100.107.739

27 December 2018

Human Metabolome Database ID

Butanedioic acid, 2-[[(2E)-3-(3,4-dihydroxyphenyl)-1-oxo-2-propen-1-yl]oxy]-3-hydroxy-, (2R,3R)- (English)

quotation

CAS no.: 67879-58-7 (English)

HMDB0013680

2 references

inferred from InChIKey

KNApSAcK ID

C00055750

2 references

inferred from InChIKey

UNII

WCV7W3174L

2 references

Global Substance Registration System

UNII

WCV7W3174L

caftaric acid (English)

14 October 2016