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Neochlorogenic Acid
Product Name: Pharmaceuticals Grade Neochlorogenic acid
CAS No.: 906-33-2
MF: C16H18O9
MW: 354.31
Purity: 99% or as customer requested
Product Categories: chemical reagent; pharmaceutical intermediate; phytochemical;
Test method: HPLC
Description
Neochlorogenic Acid, also called as Trans-5-O-caffeoyl-D-quinic acid, which is a cinnamate ester obtained by formal condensation of the carboxy group of trans-caffeic acid with the 5-hydroxy group of quinic acid. It has a role as a plant metabolite. It is a cyclitol carboxylic acid and a cinnamate ester. It derives from a (-)-quinic acid and a trans-caffeic acid. It is a conjugate acid of a trans-5-O-caffeoyl-D-quinate.
Neochlorogenic Acid Basic information
| Product Name: | Neochlorogenic acid |
| Synonyms: | [1R-(1alpha,3alpha,4alpha,5beta)]-3-[[3-(3,4-dihydroxyphenyl)-1-oxoallyl]oxy]-1,4,5-trihydroxycyclohexanecarboxylic acid;Neochlorogenic acid;5-O-CAFFEOYLQUINICACID;(1R,3R,4S,5R)-5-[(E)-3-(3,4-Dihydroxyphenyl)prop-2-enoyl]oxy-1,3,4-trihydroxycyclohexane-1-carboxylic acid;5-Caffeoylquinic acid;trans-5-O-Caffeoyl-D-quinate;Neochlorogenic acid，5-Caffeoylquinic acid，trans-5-O-Caffeoyl-D-quinate;(1R)-3β-[[3-(3,4-Dihydroxyphenyl)-1-oxo-2-propenyl]oxy]-1β,4β,5α-trihydroxycyclohexane-1α-carboxylic acid |
| CAS: | 906-33-2 |
| MF: | C16H18O9 |
| MW: | 354.31 |
| EINECS: | 212-997-1 |
| Product Categories: | chemical reagent; pharmaceutical intermediate; phytochemical; reference standards from Chinese medicinal herbs (TCM); standardized herbal extract |
| Mol File: | 906-33-2.mol |
5 Caffeoylquinic Acid Chemical Structure
5 O CAFFEOYLQUINICACID Chemical Properties
| Melting point | 204-206 °C (decomp) |
| Boiling point | 665.0±55.0 °C(Predicted) |
| density | 1.65±0.1 g/cm3(Predicted) |
| storage temp. | 2-8°C |
| pka | 3.90±0.50(Predicted) |
| form | neat |
| InChIKey | CWVRJTMFETXNAD-NXLLHMKUSA-N |
| CAS DataBase Reference | 906-33-2 |
Neochlorogenic Acid Usage And Synthesis
| Definition | ChEBI: A cinnamate ester obtained by formal condensation of the carboxy group of trans-caffeic acid with the 5-hydroxy group of quinic acid. |
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