3,5–O–Dicaffeoylquinic acid

cas: 89919-62-0 — see every product listed under this CAS number, including other names

3,5–O–Dicaffeoylquinic acid (CAS 89919-62-0) is a chemical reagent available from Chemat. Available pack sizes: 1mg, 10mg, 5mg. Offered by: GLPBio.

brandGLPBio
catalog numberGC63679-1
cas89919-62-0
size1mg
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Available pack sizes

brand size price
GLPBio 1mg 592.36 Pln
GLPBio 10mg 1163.38 Pln
GLPBio 5mg 882.55 Pln

properties

purityNo data
delivery timeTo be confirmed by Chemat
Structural formula: {0} (CAS {1})

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

Identity
Molecular formulaC25H24O12
Molecular weight516.4 g/mol
IUPAC nametrans-(3R,5R)-3,5-bis[[(E)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxy]-1,4-dihydroxycyclohexane-1-carboxylic acid
InChIKeyKRZBCHWVBQOTNZ-RDJMKVHDSA-N
SMILESC1C(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)

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