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Details

Stereochemistry ABSOLUTE
Molecular Formula C16H18O8
Molecular Weight 338.3093
Optical Activity UNSPECIFIED
Defined Stereocenters 4 / 4
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of 4-P-COUMAROYLQUINIC ACID, (Z)-

SMILES

O[C@@H]1C[C@@](O)(C[C@@H](O)[C@H]1OC(=O)\C=C/C2=CC=C(O)C=C2)C(O)=O

InChI

InChIKey=XWRHBGVVCOSNKO-JMYXGHFSSA-N
InChI=1S/C16H18O8/c17-10-4-1-9(2-5-10)3-6-13(20)24-14-11(18)7-16(23,15(21)22)8-12(14)19/h1-6,11-12,14,17-19,23H,7-8H2,(H,21,22)/b6-3-/t11-,12-,14-,16+/m1/s1

HIDE SMILES / InChI

Description

4-p-coumaroylquinic acid is one of the most abundant components of Turkish black tea Camellia sinensis L possesses antioxidant properties.

Approval Year

Unknown
139594
Conditions

Conditions

ConditionModalityTargetsHighest PhaseProduct
PubMed

PubMed

TitleDatePubMed
LC-DAD-ESI-MS/MS characterization of phenolic constituents in Turkish black tea: Effect of infusion time and temperature.
2016 Aug 1

Sample Use Guides

In Vivo Use Guide
Unknown
Route of Administration: Unknown
In Vitro Use Guide
Unknown
Name Type Language
4-P-COUMAROYLQUINIC ACID, (Z)-
Common Name English
CYCLOHEXANECARBOXYLIC ACID, 1,3,5-TRIHYDROXY-4-(((2Z)-3-(4-HYDROXYPHENYL)-1-OXO-2-PROPEN-1-YL)OXY)-, (1.ALPHA.,3R,4.ALPHA.,5R)-
Systematic Name English
CIS-4-O-COUMAROYLQUINIC ACID
Common Name English
CIS-4-P-CQA
Common Name English
Code System Code Type Description
FDA UNII
JPR656M103
Created by admin on Sat Dec 16 05:01:08 GMT 2023 , Edited by admin on Sat Dec 16 05:01:08 GMT 2023
PRIMARY
CAS
934391-78-3
Created by admin on Sat Dec 16 05:01:08 GMT 2023 , Edited by admin on Sat Dec 16 05:01:08 GMT 2023
PRIMARY
NIH
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