Products 14534-61-3

CAS 14534-61-3 appears in our catalog under these names: Isochlorogenic Acid B (3,4-Dicaffeoylquinic Acid), Isochlorogenic Acid B, Isochlorogenic acid B, 3,4-Dicaffeoylquinic acid/ 98.03% (existing batch purity), 3,4-Dicaffeoylquinic acid. Offered by: Chemat Brand, TRC, GLPBio, TargetMol, Biosynth. Available pack sizes: on request, 2,5mg, 25mg, 20mg, 1mg, 5mg, 10mg, 50mg.

Isochlorogenic Acid B (3,4-Dicaffeoylquinic Acid)
Chemat Brand
  • size: on request
  • Variants: 1
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Isochlorogenic Acid B
TRC
  • size: 2,5mg, 25mg
  • Variants: 2
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Isochlorogenic acid B
GLPBio
  • size: 20mg
  • Variants: 1
from 1228.91
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3,4-Dicaffeoylquinic acid/ 98.03% (existing batch purity)
TargetMol
  • size: 1mg, 5mg, 10mg, 25mg
  • Variants: 7
from 425.84
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3,4-Dicaffeoylquinic acid
Biosynth, Chemat
  • size: 5mg, 2mg, 10mg, 25mg
  • Variants: 6
from 924.23
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(1S,3R,4R,5R)-3,4-Bis[[3-(3,4-dihydroxyphenyl)-1-oxo-2-propenyl]oxy]-1,5-dihydroxycyclohexanecarboxylic acid, 98%, 98%
Chemat
  • size: 1mg, 5mg, 10mg, 25mg
  • Variants: 7
from 122.00
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3,4-Dicaffeoylquinic acid, 98.15%
MedChemExpress
  • size: 50 mg, 10mM/1mL, 5 mg, 100 mg
  • Variants: 7
from 389.35
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3,4-Dicaffeoylquinic acid (Standard)
MedChemExpress
  • size: 100 mg, 10 mg, 25 mg, 5 mg
  • Variants: 5
from 1559.64
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3,4-Dicaffeoylquinic acid, 2 mg
Roth
  • size: 2mg
  • Variants: 1
from 986.40
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3,4-Dicaffeoylquinic acid, 5 mg
Roth
  • size: 5mg
  • Variants: 1
from 1458.36
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3,4-Dicaffeoylquinic acid, 10 mg
Roth
  • size: 10mg
  • Variants: 1
from 2430.60
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3,4-Dicaffeoylquinic acid, 25 mg
Roth
  • size: 25mg
  • Variants: 1
from 4837.60
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3,4-Dicaffeoylquinic acid, 98%
Fluorochem
  • size: 1mg, 5mg, 10mg, 50mg
  • Variants: 5
from 180.16
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Isochlorogenic acid B, 98% (E)
Ambeed
  • size: 100mg, 250mg
  • Variants: 2
from 3057.06
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Structural formula: {0} (CAS {1})

4,5-di-O-caffeoylquinic acid is a quinic acid. It is a conjugate acid of a 4,5-di-O-caffeoyl quinate.

Source: ChEBI

Identity
Molecular formulaC25H24O12
Molecular weight516.4 g/mol
IUPAC name(1R,3R,4S,5R)-3,4-bis[[(E)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxy]-1,5-dihydroxycyclohexane-1-carboxylic acid
InChIKeyUFCLZKMFXSILNL-RVXRWRFUSA-N
SMILESC1[C@H]([C@@H]([C@@H](C[C@]1(C(=O)O)O)OC(=O)/C=C/C2=CC(=C(C=C2)O)O)OC(=O)/C=C/C3=CC(=C(C=C3)O)O)O

Computed by PubChem (NCBI)

Synonyms: 3,4-Dicaffeoylquinic acid, Isochlorogenic acid C, Isochlorogenic acid C(4,5), 3,4-Di-O-Caffeoylquinic acid, 3,4-O-dicaffeoylquinic acid, isochlorogenic-acid-c, Isochlorogenic acid C?, 4,5-Dicaffeoylquinic acids, 3,4-di-caffeoylquinic acid, 3,4-di-O-caffeoylquinicacid
Related forms of this compound
(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)-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
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
trans-(3R,5R)-3,5-bis[[(E)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxy]-1,4-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
trans-(3R,5R)-3,5-bis[[(E)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxy]-1,4-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
trans-(3R,5R)-3,5-bis[[(E)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxy]-1,4-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
(1S,3R,4R,5R)-1,3-bis[[(E)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxy]-4,5-dihydroxycyclohexane-1-carboxylic acid C25H24O12