Isochlorogenic acid A, 98% +(E), 98% +(E)

cas: 2450-53-5 — see every product listed under this CAS number, including other names

Isochlorogenic acid A, 98% +(E), 98% +(E) (CAS 2450-53-5) is a chemical reagent available from Chemat. Available pack sizes: 5mg, 50mg, 100mg, 250mg, 1g, 1mg, 10mg. Offered by: Chemat.

brandChemat
catalog numberCh1140M9-5mg
cas2450-53-5
size5mg
availability 3g
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Available pack sizes

brand size price
Chemat 5mg 155.60 Pln
Chemat 50mg 530.00 Pln
Chemat 100mg 813.20 Pln
Chemat 250mg 1341.20 Pln
Chemat 1g 3510.80 Pln
Chemat 1mg 98.00 Pln
Chemat 10mg 208.40 Pln

properties

purity98% +(E)
delivery time3 weeks
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)

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
Related forms of this compound
trans-(3R,5R)-3,5-bis[[(E)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxy]-1,4-dihydroxycyclohexane-1-carboxylic acid C25H24O12
trans-(3R,5R)-3,5-bis[[(E)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxy]-1,4-dihydroxycyclohexane-1-carboxylic acid C25H24O12
Isomers (same molecular formula)
(1S,3R,4R,5R)-1,3-bis[[(E)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxy]-4,5-dihydroxycyclohexane-1-carboxylic acid C25H24O12
(1R,3R,4S,5R)-3,4-bis[[(E)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxy]-1,5-dihydroxycyclohexane-1-carboxylic acid C25H24O12
(1S,3R,4R,5R)-3,4-bis[[(E)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxy]-1,5-dihydroxycyclohexane-1-carboxylic acid C25H24O12
(1R,3R,4S,5R)-1,3-bis[3-(3,4-dihydroxyphenyl)prop-2-enoyloxy]-4,5-dihydroxycyclohexane-1-carboxylic acid C25H24O12
[(2S,3S,4S,5R,6S)-4-acetyloxy-6-[5,7-dihydroxy-2-(4-hydroxyphenyl)-4-oxochromen-3-yl]oxy-5-hydroxy-2-methyloxan-3-yl] acetate C25H24O12
trans-(3R,5R)-1,4-bis[[(E)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxy]-3,5-dihydroxycyclohexane-1-carboxylic acid C25H24O12
(1R,3R,4S,5R)-1,3-bis[[(E)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxy]-4,5-dihydroxycyclohexane-1-carboxylic acid C25H24O12
(1R,3R,4S,5R)-3,4-bis[[(E)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxy]-1,5-dihydroxycyclohexane-1-carboxylic acid C25H24O12
(1S,3R,4R,5R)-1,3-bis[[(E)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxy]-4,5-dihydroxycyclohexane-1-carboxylic acid C25H24O12
(1S,3R,4R,5R)-3,4-bis[[(E)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxy]-1,5-dihydroxycyclohexane-1-carboxylic acid C25H24O12

Also listed as

Isochlorogenic acid a, 95% Combi-blocks CAS 2450-53-5
Isochlorogenic Acid A, >95% (HPLC) TRC CAS 2450-53-5
Isochlorogenic acid A GLPBio CAS 2450-53-5
Isochlorogenic acid A/ 99.53% (existing batch purity) TargetMol CAS 2450-53-5
3,5-Dicaffeoylquinic acid Biosynth CAS 2450-53-5
3,5-Dicaffeoylquinic acid, 98.00% Chemat CAS 2450-53-5
Isochlorogenic acid A, 99.53% MedChemExpress CAS 2450-53-5
Isochlorogenic acid A (Standard) MedChemExpress CAS 2450-53-5
3,5-Dicaffeoylquinic acid, 10 mg Roth CAS 2450-53-5
3,5-Dicaffeoylquinic acid, 25 mg Roth CAS 2450-53-5
3,5-Dicaffeoylquinic acid, 50 mg Roth CAS 2450-53-5
3,5-Di-O-caffeoylquinic acid, 98+% Fluorochem CAS 2450-53-5
Isochlorogenic acid A, 98% +(E) Ambeed CAS 2450-53-5