4–Demethyltraxillaside

cas: 1691201-82-7 — see every product listed under this CAS number, including other names

4–Demethyltraxillaside (CAS 1691201-82-7) is a chemical reagent available from Chemat. Available pack sizes: 5mg. Offered by: GLPBio.

brandGLPBio
catalog numberGF25361-5mg
cas1691201-82-7
size5mg
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Available pack sizes

brand size price
GLPBio 5mg 3648.73 Pln

properties

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delivery timeTo be confirmed by Chemat
Structural formula: {0} (CAS {1})

(3R,4R)-4-[(4-hydroxy-3,5-dimethoxyphenyl)methyl]-3-[[3-methoxy-4-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]methyl]oxolan-2-one (CAS 1691201-82-7) is a chemical compound with the molecular formula C27H34O12 and a molecular weight of 550.6 g/mol. IUPAC name: (3R,4R)-4-[(4-hydroxy-3,5-dimethoxyphenyl)methyl]-3-[[3-methoxy-4-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]methyl]oxolan-2-one. InChIKey: NDOXNRJTLLYHPX-VHDPVITESA-N.

Identity
Molecular formulaC27H34O12
Molecular weight550.6 g/mol
IUPAC name(3R,4R)-4-[(4-hydroxy-3,5-dimethoxyphenyl)methyl]-3-[[3-methoxy-4-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]methyl]oxolan-2-one
InChIKeyNDOXNRJTLLYHPX-VHDPVITESA-N
SMILESCOC1=CC(=CC(=C1O)OC)C[C@H]2COC(=O)[C@@H]2CC3=CC(=C(C=C3)O[C@H]4[C@@H]([C@H]([C@@H]([C@H](O4)CO)O)O)O)OC

Computed by PubChem (NCBI)

Synonyms: 4-Demethyltraxillaside, 5'-Methoxymatairesinoside, orb1681300
Isomers (same molecular formula)
(3S,4S)-4-[(3,4-dimethoxyphenyl)methyl]-3-hydroxy-3-[[3-methoxy-4-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]methyl]oxolan-2-one C27H34O12
methyl (2S,6S,6aR,9R,10aS,10bS)-2-(furan-3-yl)-9-hydroxy-6a,10b-dimethyl-4-oxo-6-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-1,2,6,9,10,10a-hexahydrobenzo[f]isochromene-7-carboxylate C27H34O12
(1R,2S,3R,6R,8R,13S,14R,15R,16S,17S)-10,15,16-trihydroxy-3-[(E)-4-hydroxy-3,4-dimethylpent-2-enoyl]oxy-9,13-dimethyl-4,11-dioxo-5,18-dioxapentacyclo[12.5.0.01,6.02,17.08,13]nonadec-9-ene-17-carboxylic acid C27H34O12
(3S,4R)-4-[(3,4-dimethoxyphenyl)methyl]-3-[(R)-hydroxy-[3-methoxy-4-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]methyl]oxolan-2-one C27H34O12

Also listed as

(3R,4R)-3-[[4-(β-D-Glucopyranosyloxy)-3-methoxyphenyl]methyl]dihydro-4-[(4-hydroxy-3,5-dimethoxyphenyl)methyl]-2(3H)-furanone, ≥95%, ≥95% Chemat CAS 1691201-82-7
4-Demethyltraxillaside MedChemExpress CAS 1691201-82-7