SMB01083

4,5-Di-O-caffeoylquinic acid methyl ester

≥90% (LC/MS-ELSD)

• Synonim(y): Methyl (1R,3R,4S,5R)-3,4-bis[[(E)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxy]-1,5-dihydroxycyclohexane-1-carboxylate
• Wzór empiryczny (zapis Hilla): C₂₆H₂₆O₁₂
• Numer CAS: 188742-80-5
• Masa cząsteczkowa: 530.48
• UNSPSC Code: 12352205
• NACRES: NA.25

Właściwości

• biological source: plant
• assay: ≥90% (LC/MS-ELSD)
• form: solid
• mol wt: 530.48
• application(s): metabolomics; vitamins, nutraceuticals, and natural products
• storage temp.: −20°C
• SMILES string: O([C@@H]2[C@@H](C[C@@](C[C@H]2O)(O)C(=O)OC)OC(=O)\C=C\c3cc(c(cc3)O)O)C(=O)\C=C\c1cc(c(cc1)O)O
• InChI: 1S/C26H26O12/c1-36-25(34)26(35)12-20(31)24(38-23(33)9-5-15-3-7-17(28)19(30)11-15)21(13-26)37-22(32)8-4-14-2-6-16(27)18(29)10-14/h2-11,20-21,24,27-31,35H,12-13H2,1H3/b8-4+,9-5+/t20-,21-,24+,26-/m1/s1
• InChI key: PKJBSZTYNDRXEQ-GMGOHGFSSA-N

Opis

General description

4,5-Di-O-caffeoylquinic acid methyl ester, a phenylpropanoid, belongs to group of compounds known as cyclic alcohols and derivatives. It is a natural product commonly available from Erigeron breviscapus, Spuriopimpinella brachycarpa, Ipomoea batatas L., and Spuriopimpinella calycina plants. Studies have demonstrated that this metabolite, derived from plant sources, possesses various biological activities, including antioxidant and antiviral properties.

Application

It is a natural product derived from plant source that finds application in compound screening libraries, metabolomics, phytochemical, and pharmaceutical research.

Biochem/physiol Actions

4,5-Di-O-caffeoylquinic acid methyl ester demonstrates strong antioxidant activity with significant free radical-scavenging abilities against DPPH. Additionally, it displays in vitro antiviral activity against the respiratory syncytial virus.

Features and Benefits

• High quality compound suitable for multiple research applications
• Compatible with HPLC and mass spectrometry techniques

Other Notes

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Informacja o środkach bezpieczeństwa

• Klasa składowania: 11 - Combustible Solids
• wgk: WGK 3
• flash_point_f: Not applicable
• flash_point_c: Not applicable