(Q104254155)

English

(3R,5R)-4-{[(2E)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxy}-1,3,5-trihydroxycyclohexane-1-carboxylic acid

chemical compound

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instance of

type of chemical entity

0 references

subclass of

4-Caffeoylquinic acid;4-O-Caffeoylquinic acid

1 reference

based on heuristic

inferred from SMILES

mass

354.095082156 dalton

1 reference

based on heuristic

inferred from SMILES

stereoisomer of

(Z)-cryptochlorogenic acid

2 references

based on heuristic

inferred from InChIKey

based on heuristic

inferred from InChI

(1R,3R,4R,5R)-4-{[(2E)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxy}-1,3,5-trihydroxycyclohexane-1-carboxylic acid

2 references

based on heuristic

inferred from InChIKey

based on heuristic

inferred from InChI

cryptochlorogenic acid

1 reference

based on heuristic

inferred from InChI

chemical formula

C₁₆H₁₈O₉

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canonical SMILES

O=C(O)C1(O)CC(O)C(OC(=O)C=CC2=CC=C(O)C(O)=C2)C(O)C1

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isomeric SMILES

O=C(/C=C/c1ccc(O)c(O)c1)OC1[C@H](O)CC(O)(C(=O)O)C[C@H]1O

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found in taxon

Prunus dulcis

1 reference

stated in

Antioxidant constituents of almond [Prunus dulcis (Mill.) D.A. Webb] hulls

Cynara scolymus

2 references

stated in

HPLC Evaluation of the Active Constituents in the Newly Introduced Romanian Strain of Cynara scolymus Cultivated in Egypt

stated in

High-performance liquid chromatography of caffeoylquinic acid derivatives of Cynara scolymus L. leaves

Achillea cartilaginea

1 reference

stated in

Dicaffeolyquinic acids from Helichrysum italicum and Achillea cartilaginea

Artemisia absinthium

1 reference

stated in

A study of the chemical composition of a wormwood infusion

Centaurea horrida

1 reference

stated in

Secondary constituents from Centaurea horrida and their evolutionary meaning

Coffea arabica

1 reference

stated in

Chlorogenic acid composition of instant coffees

Coffea canephora

2 references

stated in

3-O-caffeoyl-4-O-feruloylquinic acid from green robusta coffee beans

stated in

Hydroxycinnamic Acid Derivatives andp-Coumaroyl-(L)-trypropban, A NovelHydroxycinnamic Acid Derivative, from Coffee Beans

1 reference

1 reference

Dicaffeolyquinic acids from Helichrysum italicum and Achillea cartilaginea

Helichrysum stoechas

1 reference

stated in

LC coupled to ion-trap MS for the rapid screening and detection of polyphenol antioxidants from Helichrysum stoechas

Hydrangea macrophylla

1 reference

stated in

Copigments in the blueing of sepal colour of Hydrangea macrophylla

Hypericum perforatum

1 reference

stated in

Phenolic compounds from Hypericum perforatum

Matricaria chamomilla

1 reference

stated in

Characterization ofMatricaria recutita L. Flower extracts by HPLC-MS and HPLC-DAD analysis

Prunus domestica

5 references

stated in

Identification, quantitative determination, and antioxidative activities of chlorogenic acid isomers in prune (Prunus domestica L. ).

stated in

Antioxidant activity of prune (Prunus domestica L.) constituents and a new synergist

stated in

LC/MS/MS characterization of phenolic constituents in dried plums

stated in

Quantitative evaluation of antioxidant components in prunes (Prunus domestica L.).

stated in

Accumulation of Caffeoyl-D-quinic Acids and Catechins in Plums Affected by the Fungus Taphrina pruni

Rubus ulmifolius

1 reference

stated in

In vitro antimicrobial activity of extracts and isolated constituents of Rubus ulmifolius

Solidago altissima

1 reference

stated in

A new kaempferol trioside from Solidago altissima L.

Vaccinium arctostaphylos

1 reference

stated in

An antidiabetic compound from Vaccinium arctostaphylos berries

Viburnum dilatatum

1 reference

stated in

Phenolic compounds from Viburnum dilatatum

Withania somnifera

1 reference

stated in

Flavonol glycosides and phenolics from Withania somnifera

Xanthium strumarium

1 reference

stated in

Bioactivity-guided fractionation for anti-inflammatory and analgesic properties and constituents of Xanthium strumarium L

Erigeron breviscapus

1 reference

stated in

Characterization of phenolic compounds in Erigeron breviscapus by liquid chromatography coupled to electrospray ionization mass spectrometry

Aster tataricus

1 reference

stated in

Expectorant, antitussive, anti-inflammatory activities and compositional analysis of Aster tataricus

Cynara cardunculus

3 references

stated in

HPLC Evaluation of the Active Constituents in the Newly Introduced Romanian Strain of Cynara scolymus Cultivated in Egypt

stated in

High-performance liquid chromatography of caffeoylquinic acid derivatives of Cynara scolymus L. leaves

stated in

Metabolomics driven analysis of artichoke leaf and its commercial products via UHPLC-q-TOF-MS and chemometrics

Chamomilla recutita

1 reference

stated in

Characterization ofMatricaria recutita L. Flower extracts by HPLC-MS and HPLC-DAD analysis

Phlomoides tuberosa

1 reference

stated in

Polyphenolic compounds of Scabiosa caucasica

Prunus avium

1 reference

stated in

Antioxidant constituents of almond [Prunus dulcis (Mill.) D.A. Webb] hulls

Oenothera biennis

1 reference

stated in

Chemical Composition, Antioxidative and Anti-Inflammatory Activity of Extracts Prepared from Aerial Parts of Oenothera biennis L. and Oenothera paradoxa Hudziok Obtained after Seeds Cultivation

Identifiers

InChI

InChI=1S/C16H18O9/c17-9-3-1-8(5-10(9)18)2-4-13(21)25-14-11(19)6-16(24,15(22)23)7-12(14)20/h1-5,11-12,14,17-20,24H,6-7H2,(H,22,23)/b4-2+/t11-,12-,14?,16?/m1/s1

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InChIKey

GYFFKZTYYAFCTR-AVXJPILUSA-N

0 references

2 references

26 December 2021

matched by identifier from

InChIKey

GYFFKZTYYAFCTR-AVXJPILUSA-N

1 reference

0 references

(Q104254155)

(3R,5R)-4-{[(2E)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxy}-1,3,5-trihydroxycyclohexane-1-carboxylic acid

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