3,4-Di-O-caffeoyl quinic acid methyl ester, 98.77%

cas: 114637-83-1 — see every product listed under this CAS number, including other names

3,4-Di-O-caffeoyl quinic acid methyl ester, 98.77% (CAS 114637-83-1) is a chemical reagent available from Chemat. Available pack sizes: 5 mg, 10 mg. Offered by: MedChemExpress.

brandMedChemExpress
catalog numberHY-N8448-5 mg
cas114637-83-1
size5 mg
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Available pack sizes

brand size price
MedChemExpress 5 mg 1127.75 Pln
MedChemExpress 10 mg 1731.47 Pln

properties

delivery time over 3 weeks
purity98.77%
Structural formula: {0} (CAS {1})

Methyl (1S,3R,4R,5R)-3,4-bis[[(E)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxy]-1,5-dihydroxycyclohexane-1-carboxylate (CAS 114637-83-1) is a chemical compound with the molecular formula C26H26O12 and a molecular weight of 530.5 g/mol. IUPAC name: methyl (1S,3R,4R,5R)-3,4-bis[[(E)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxy]-1,5-dihydroxycyclohexane-1-carboxylate. InChIKey: PKJBSZTYNDRXEQ-VOHNXBSUSA-N.

Identity
Molecular formulaC26H26O12
Molecular weight530.5 g/mol
IUPAC namemethyl (1S,3R,4R,5R)-3,4-bis[[(E)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxy]-1,5-dihydroxycyclohexane-1-carboxylate
InChIKeyPKJBSZTYNDRXEQ-VOHNXBSUSA-N
SMILESCOC(=O)[C@@]1(C[C@H]([C@H]([C@@H](C1)OC(=O)/C=C/C2=CC(=C(C=C2)O)O)OC(=O)/C=C/C3=CC(=C(C=C3)O)O)O)O

Computed by PubChem (NCBI)

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