Products 19870-46-3

CAS 19870-46-3 appears in our catalog under these names: 1,5-Dicaffeoylquinic acid, min. 95 %, 25 mg, 1,3-O-Dicaffeoylquinic acid, 95%, 1,5-Dicaffeoylquinic Acid, 1,3-Dicaffeoylquinic Acid, >95% (HPLC), 1,3-Dicaffeoylquinic acid/ 98.68% (existing batch purity). Offered by: Roth, Combi-blocks, Chemat Brand, TRC, TargetMol. Available pack sizes: 25mg, 250mg, 1g, 100mg, on request, 2,5mg, 5mg, 20mg.

Structural formula: {0} (CAS {1})

(1S,3R,4R,5R)-1,3-bis[[(E)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxy]-4,5-dihydroxycyclohexane-1-carboxylic acid (CAS 19870-46-3) is a chemical compound with the molecular formula C25H24O12 and a molecular weight of 516.4 g/mol. IUPAC name: (1S,3R,4R,5R)-1,3-bis[[(E)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxy]-4,5-dihydroxycyclohexane-1-carboxylic acid. InChIKey: YDDUMTOHNYZQPO-PSEXTPKNSA-N.

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

Computed by PubChem (NCBI)