Products 2450-53-5
CAS 2450-53-5 appears in our catalog under these names: Isochlorogenic acid a, 95%, Isochlorogenic Acid A, >95% (HPLC), Isochlorogenic acid A, Isochlorogenic acid A/ 99.53% (existing batch purity), 3,5-Dicaffeoylquinic acid. Offered by: Combi-blocks, TRC, GLPBio, TargetMol, Biosynth. Available pack sizes: 250mg, 100mg, 50mg, 5mg, 20mg, 10mg, 25mg, 500mg.
3,5-di-O-caffeoyl quinic acid is a carboxylic ester that is the diester obtained by the condensation of the hydroxy groups at positions 3 and 5 of ()-quinic acid with the carboxy group of trans-caffeic acid. Isolated from Brazilian propolis and Suaeda glauca, it exhibits hepatoprotective and cytotoxic activities. It has a role as a metabolite, an antineoplastic agent and a hepatoprotective agent. It is a carboxylic ester and a cyclitol carboxylic acid. It is functionally related to a trans-caffeic acid and a (-)-quinic acid. It is a conjugate acid of a 3,5-di-O-caffeoyl quinate.
Source: ChEBI
| Molecular formula | C25H24O12 |
|---|---|
| Molecular weight | 516.4 g/mol |
| IUPAC name | trans-(3R,5R)-3,5-bis[[(E)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxy]-1,4-dihydroxycyclohexane-1-carboxylic acid |
| InChIKey | KRZBCHWVBQOTNZ-RDJMKVHDSA-N |
| SMILES | C1C(C[C@H](C([C@@H]1OC(=O)/C=C/C2=CC(=C(C=C2)O)O)O)OC(=O)/C=C/C3=CC(=C(C=C3)O)O)(O)C(=O)O |
Computed by PubChem (NCBI)
Synonyms:
Isochlorogenic acid A, 3,5-Dicaffeoylquinic acid, 3,5-Di-O-caffeoylquinic acid, 3,5-Dicaffeoyl-epi-quinic acid, (E,E)-3,5-Di-O-caffeoylquinic acid, Quinic acid 3,5-di-O-caffeate, 3,5-O-dicaffeoylquinic acid, (-)-3,5-Dicaffeoyl quinic acid, 3,5-dicaffeoylquinate, 3,5-Dicaffeoylquininic acid