Products 158500-59-5

CAS 158500-59-5 is the registry number for Cnidioside B methyl ester. Offered by: Biosynth, MedChemExpress. Available pack sizes: 25mg, 10mg, 50mg, Get quote.

Cnidioside B methyl ester
Biosynth, MedChemExpress
  • size: 25mg, 10mg, 50mg, Get quote
  • Variants: 4
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Structural formula: {0} (CAS {1})

Methyl 3-[7-methoxy-6-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-1-benzofuran-5-yl]propanoate (CAS 158500-59-5) is a chemical compound with the molecular formula C19H24O10 and a molecular weight of 412.4 g/mol. IUPAC name: methyl 3-[7-methoxy-6-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-1-benzofuran-5-yl]propanoate. InChIKey: AARIHENRSOEJOC-DGQOTAAJSA-N.

Identity
Molecular formulaC19H24O10
Molecular weight412.4 g/mol
IUPAC namemethyl 3-[7-methoxy-6-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-1-benzofuran-5-yl]propanoate
InChIKeyAARIHENRSOEJOC-DGQOTAAJSA-N
SMILESCOC1=C2C(=CC(=C1O[C@H]3[C@@H]([C@H]([C@@H]([C@H](O3)CO)O)O)O)CCC(=O)OC)C=CO2

Computed by PubChem (NCBI)

Synonyms: Cnidioside B methyl ester, CnidiosideBmethylester, orb1681080, 5-Benzofuranpropanoic acid, 6-(-D-glucopyranosyloxy)-7-methoxy-, methyl ester
Isomers (same molecular formula)
[(2R,3R,4S,5R,6S)-4,5-diacetyloxy-3-hydroxy-6-(4-methoxyphenoxy)oxan-2-yl]methyl acetate C19H24O10
(4aS,6R,7R,8R,8aS)-6-[[(1R,2S,3R,4R,5R)-3,4-dihydroxy-6,8-dioxabicyclo[3.2.1]octan-2-yl]oxy]-2-phenyl-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxine-7,8-diol C19H24O10