Products 69624-79-9

CAS 69624-79-9 appears in our catalog under these names: Quercetin-3-O-(2′′-O-galloyl)-β-D-glucopyranoside, ≥98%, ≥98%, Quercetin-3-O-(2′′-O-galloyl)-β-D-glucopyranoside. Offered by: Chemat, MedChemExpress. Available pack sizes: 5mg, 10 mg, 1 mg, 25 mg, 5 mg.

Quercetin-3-O-(2′′-O-galloyl)-β-D-glucopyranoside, ≥98%, ≥98%
Chemat
  • size: 5mg
  • Variants: 1
from 3760.40
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Quercetin-3-O-(2′′-O-galloyl)-β-D-glucopyranoside
MedChemExpress
  • size: 10 mg, 1 mg, 25 mg, 5 mg
  • Variants: 4
from 1801.13
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Structural formula: {0} (CAS {1})

[(2S,3R,4S,5S,6R)-2-[2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-4-oxochromen-3-yl]oxy-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl] 3,4,5-trihydroxybenzoate (CAS 69624-79-9) is a chemical compound with the molecular formula C28H24O16 and a molecular weight of 616.5 g/mol. IUPAC name: [(2S,3R,4S,5S,6R)-2-[2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-4-oxochromen-3-yl]oxy-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl] 3,4,5-trihydroxybenzoate. InChIKey: PXGWEUQZDRUMRE-KQOASZHBSA-N.

Identity
Molecular formulaC28H24O16
Molecular weight616.5 g/mol
IUPAC name[(2S,3R,4S,5S,6R)-2-[2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-4-oxochromen-3-yl]oxy-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl] 3,4,5-trihydroxybenzoate
InChIKeyPXGWEUQZDRUMRE-KQOASZHBSA-N
SMILESC1=CC(=C(C=C1C2=C(C(=O)C3=C(C=C(C=C3O2)O)O)O[C@H]4[C@@H]([C@H]([C@@H]([C@H](O4)CO)O)O)OC(=O)C5=CC(=C(C(=C5)O)O)O)O)O

Computed by PubChem (NCBI)

Synonyms: Quercetin-3-O-(2''-O-galloyl)-beta-D-glucopyranoside, orb1943440, quercetin-3-O-(2''-gallate)-glucoside, quercetin-3-O-D-(2''-gallate)-glucoside, quercetin 3-O-(2''-O-galloyl)-beta-D-glucoside, Quercetin-3-O-(2-O-galloyl)-beta-D-glucopyranoside, Quercetin-3-O-(2''-O-galloyl)-|?-D-glucopyranoside, Quercetin-3-O-(2''-O-galloyl)-|A-D-glucopyranoside, Quercetin-3-O-(2a(2)a(2)-O-galloyl)-I(2)-D-glucopyranoside
Related forms of this compound
[(2S,3R,4S,5R,6R)-2-[2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-4-oxochromen-3-yl]oxy-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl] 3,4,5-trihydroxybenzoate C28H24O16
Isomers (same molecular formula)
[(2R,3R,4S,5R,6S)-6-[2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-4-oxochromen-3-yl]oxy-3,4,5-trihydroxyoxan-2-yl]methyl 3,4,5-trihydroxybenzoate C28H24O16
[(2S,3R,4R,5R,6S)-2-[5,7-dihydroxy-4-oxo-2-(3,4,5-trihydroxyphenyl)chromen-3-yl]oxy-4,5-dihydroxy-6-methyloxan-3-yl] 3,4,5-trihydroxybenzoate C28H24O16
[(2S,3R,4R,5S,6S)-2-[5,7-dihydroxy-4-oxo-2-(3,4,5-trihydroxyphenyl)chromen-3-yl]oxy-3,5-dihydroxy-6-methyloxan-4-yl] 3,4,5-trihydroxybenzoate C28H24O16
[(2R,3S,4S,5R,6S)-6-[2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-4-oxochromen-3-yl]oxy-3,4,5-trihydroxyoxan-2-yl]methyl 3,4,5-trihydroxybenzoate C28H24O16