(S)-2-(2-Hydroxypropan-2-yl)-4-methoxy-7-((((2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)methyl)-2H-furo[3,2-g]chromen-5(3H)-one, 95%

cas: 80681-45-4 — see every product listed under this CAS number, including other names

(S)-2-(2-Hydroxypropan-2-yl)-4-methoxy-7-((((2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)methyl)-2H-furo[3,2-g]chromen-5(3H)-one, 95% (CAS 80681-45-4) is a chemical reagent available from Chemat. Available pack sizes: 100mg, 250mg. Offered by: Fluorochem.

brand	Fluorochem
catalog number	F868777-100MG
cas	80681-45-4
size	100mg

Documents: Safety Data Sheet (MSDS)

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• 2D
• 3D

PRIM-O-GLUCOSYLCIMIFUGIN is an organic heterotricyclic compound and an oxacycle.

Source: ChEBI

Identity

Molecular formula	C22H28O11
Molecular weight	468.4 g/mol
IUPAC name	(2S)-2-(2-hydroxypropan-2-yl)-4-methoxy-7-[[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]-2,3-dihydrofuro[3,2-g]chromen-5-one
InChIKey	XIUVHOSBSDYXRG-UVTAEQIVSA-N
SMILES	CC(C)([C@@H]1CC2=C(O1)C=C3C(=C2OC)C(=O)C=C(O3)CO[C@H]4[C@@H]([C@H]([C@@H]([C@H](O4)CO)O)O)O)O

Computed by PubChem (NCBI)

Synonyms: Prim-O-glucosylcimifugin, prime-O-glucosylcimifugin, CIMIFUGINBETA-D-GLUCOPYRANOSIDE, Cimifugin beta-D-glucopyranoside, cimifugin glucoside, Cimicifuga glycoside, cimifugin-3-O-glucoside, 1''-O-glucosylcimifugin, prim-O-glucosyl cimifugin, prim-O-glucosyl-cimifugin

Isomers (same molecular formula)

(2S,3S,5R,6S)-6-[2-(2-ethyl-5-oxohexoxy)carbonylbenzoyl]oxy-3,4,5-trihydroxyoxane-2-carboxylic acid C₂₂H₂₈O₁₁

[(1S,4aS,5R,7S,7aS)-4a,5-dihydroxy-7-methyl-1-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-1,5,6,7a-tetrahydrocyclopenta[c]pyran-7-yl] benzoate C₂₂H₂₈O₁₁

(2S)-7-(hydroxymethyl)-4-methoxy-2-[2-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxypropan-2-yl]-2,3-dihydrofuro[3,2-g]chromen-5-one C₂₂H₂₈O₁₁