Products 38482-82-5

CAS 38482-82-5 is the registry number for R,S-Equol 7-b-D-glucuronide sodium salt. Offered by: Biosynth. Available pack sizes: 2mg, 1mg, 5mg.

R,S-Equol 7-b-D-glucuronide sodium salt
Biosynth
  • size: 2mg, 1mg, 5mg
  • Variants: 3
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Structural formula: {0} (CAS {1})

(3S,4R,6S)-3,4,5-trihydroxy-6-[[3-(4-hydroxyphenyl)-3,4-dihydro-2H-chromen-7-yl]oxy]oxane-2-carboxylic acid (CAS 38482-82-5) is a chemical compound with the molecular formula C21H22O9 and a molecular weight of 418.4 g/mol. IUPAC name: (3S,4R,6S)-3,4,5-trihydroxy-6-[[3-(4-hydroxyphenyl)-3,4-dihydro-2H-chromen-7-yl]oxy]oxane-2-carboxylic acid. InChIKey: XDPLKWRSVXUQBN-XYFRAQCOSA-N.

Identity
Molecular formulaC21H22O9
Molecular weight418.4 g/mol
IUPAC name(3S,4R,6S)-3,4,5-trihydroxy-6-[[3-(4-hydroxyphenyl)-3,4-dihydro-2H-chromen-7-yl]oxy]oxane-2-carboxylic acid
InChIKeyXDPLKWRSVXUQBN-XYFRAQCOSA-N
SMILESC1C(COC2=C1C=CC(=C2)O[C@H]3C([C@@H]([C@@H](C(O3)C(=O)O)O)O)O)C4=CC=C(C=C4)O

Computed by PubChem (NCBI)

Synonyms: R,S-Equol 7-b-D-glucuronide sodium salt, 3,4-Dihydro-3-(4-hydroxyphenyl)-2H-1-benzopyran-7-yl-b-D-glucuronide
Isomers (same molecular formula)
5-hydroxy-6,7,8-trimethoxy-2-(3,4,5-trimethoxyphenyl)chromen-4-one C21H22O9
(10R)-1,8-dihydroxy-3-(hydroxymethyl)-10-[(2S,3R,4R,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]-10H-anthracen-9-one C21H22O9
(2S)-7-hydroxy-2-[4-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]-2,3-dihydrochromen-4-one C21H22O9
(10S)-1,8-dihydroxy-3-(hydroxymethyl)-10-[(2S,3R,4R,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]-10H-anthracen-9-one C21H22O9
(2S,3S,4S,5R,6S)-3,4,5-trihydroxy-6-[2-(2-phenoxyphenyl)propanoyloxy]oxane-2-carboxylic acid C21H22O9
(2S)-2-(4-hydroxyphenyl)-7-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-2,3-dihydrochromen-4-one C21H22O9
(E)-3-(4-hydroxyphenyl)-1-[2-hydroxy-4-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]prop-2-en-1-one C21H22O9
5-hydroxy-3,7-bis(methoxymethoxy)-2-[4-(methoxymethoxy)phenyl]chromen-4-one C21H22O9
1,8-dihydroxy-3-(hydroxymethyl)-10-[(2S,3R,4R,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]-10H-anthracen-9-one C21H22O9
3-(4-hydroxyphenyl)-7-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-2,3-dihydrochromen-4-one C21H22O9
(E)-1-(2,4-dihydroxyphenyl)-3-[4-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]prop-2-en-1-one C21H22O9
(2S)-5-hydroxy-2-phenyl-7-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-2,3-dihydrochromen-4-one C21H22O9