Products 952068-64-3

CAS 952068-64-3 is the registry number for Parishin D. Offered by: Chemat Brand. Available pack sizes: on request.

Parishin D
Chemat Brand
  • size: on request
  • Variants: 1
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Structural formula: {0} (CAS {1})

2-hydroxy-4-[(4-hydroxyphenyl)methoxy]-2-[2-[(4-hydroxyphenyl)methoxy]-2-oxoethyl]-4-oxobutanoic acid (CAS 952068-64-3) is a chemical compound with the molecular formula C20H20O9 and a molecular weight of 404.4 g/mol. IUPAC name: 2-hydroxy-4-[(4-hydroxyphenyl)methoxy]-2-[2-[(4-hydroxyphenyl)methoxy]-2-oxoethyl]-4-oxobutanoic acid. InChIKey: MSRSPFUOJYFBJA-UHFFFAOYSA-N.

Identity
Molecular formulaC20H20O9
Molecular weight404.4 g/mol
IUPAC name2-hydroxy-4-[(4-hydroxyphenyl)methoxy]-2-[2-[(4-hydroxyphenyl)methoxy]-2-oxoethyl]-4-oxobutanoic acid
InChIKeyMSRSPFUOJYFBJA-UHFFFAOYSA-N
SMILESC1=CC(=CC=C1COC(=O)CC(CC(=O)OCC2=CC=C(C=C2)O)(C(=O)O)O)O

Computed by PubChem (NCBI)

Synonyms: Parishin D, orb1984269, 1,3-bis(4-hydroxybenzyl)citrate
Isomers (same molecular formula)
(2S,3S,4S,5R,6S)-6-[4-[(E)-2-(3,5-dihydroxyphenyl)ethenyl]phenoxy]-3,4,5-trihydroxyoxane-2-carboxylic acid C20H20O9
(2S,3S,4S,5R,6S)-3,4,5-trihydroxy-6-[2,3,5,6-tetradeuterio-4-[(E)-2-(3,5-dihydroxyphenyl)ethenyl]phenoxy]oxane-2-carboxylic acid C20H20O9
(2S,3S,4S,5R,6S)-3,4,5-trihydroxy-6-[3-hydroxy-5-[(E)-2-(4-hydroxyphenyl)ethenyl]phenoxy]oxane-2-carboxylic acid C20H20O9
(2S,3S,4S,5R,6S)-3,4,5-trihydroxy-6-[3-hydroxy-5-[(Z)-2-(4-hydroxyphenyl)ethenyl]phenoxy]oxane-2-carboxylic acid C20H20O9