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180981-12-8

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180981-12-8 Structure

180981-12-8 Structure
IdentificationBack Directory
[Name]

3-O-Caffeoylshikimic acid
[CAS]

180981-12-8
[Synonyms]

3-O-Caffeoylshikimic acid
1-Cyclohexene-1-carboxylic acid, 3-[[(2E)-3-(3,4-dihydroxyphenyl)-1-oxo-2-propen-1-yl]oxy]-4,5-dihydroxy-, (3R,4S,5R)-
[Molecular Formula]

C16H16O8
[MOL File]

180981-12-8.mol
[Molecular Weight]

336.29
Chemical PropertiesBack Directory
[Boiling point ]

632.6±55.0 °C(Predicted)
[density ]

1.60±0.1 g/cm3(Predicted)
[pka]

4.27±0.70(Predicted)
Hazard InformationBack Directory
[Uses]

3-O-Caffeoylshikimic acid (Compound 8) is a phenolic and can be isolated from Livistona chinensis. 3-O-Caffeoylshikimic acid is an antioxidant agent. 3-O-Caffeoylshikimic acid inhibits the proliferation of human cancer cells HepG2, HL-60, K562, and CNE-1 with IC50s of 5-150 μM[1].
[Definition]

ChEBI: 3-O-Caffeoylshikimic acid is a hydroxycinnamic acid.
[References]

[1] Zeng X, et al., Bioactive phenolics from the fruits of Livistona chinensis. Fitoterapia. 2012 Jan;83(1):104-9. DOI:10.1016/j.fitote.2011.09.020
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