Oxypaeoniflorin

cas: 39011-91-1 — see every product listed under this CAS number, including other names

Oxypaeoniflorin (CAS 39011-91-1) is a chemical reagent available from Chemat. Available pack sizes: 20mg. Offered by: GLPBio.

brandGLPBio
catalog numberGN10188-20
cas39011-91-1
size20mg
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Available pack sizes

brand size price
GLPBio 20mg 929.36 Pln

properties

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

Oxypaeoniflorin is a monoterpene glycoside with formula C23H28O12, isolated from several species of Paeoniae. It has a role as a plant metabolite. It is a beta-D-glucoside, a bridged compound, a lactol, a cyclic acetal, a monoterpene glycoside and a 4-hydroxybenzoate ester.

Source: ChEBI

Identity
Molecular formulaC23H28O12
Molecular weight496.5 g/mol
IUPAC name[(1R,2S,3R,5R,6R,8S)-6-hydroxy-8-methyl-3-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-9,10-dioxatetracyclo[4.3.1.02,5.03,8]decan-2-yl]methyl 4-hydroxybenzoate
InChIKeyFCHVXNVDFYXLIL-WRJNSLSBSA-N
SMILESC[C@]12C[C@@]3([C@@H]4C[C@]1([C@@]4([C@H](O2)O3)COC(=O)C5=CC=C(C=C5)O)O[C@H]6[C@@H]([C@H]([C@@H]([C@H](O6)CO)O)O)O)O

Computed by PubChem (NCBI)

Synonyms: Oxypaeoniflorin, Oxypaeoniflora, OXYPEONIFLORIN, Oxypaeoniflorin (Standard), orb1222292, orb1303768, orb3140821
Isomers (same molecular formula)
(1S,4aS,7S,7aS)-7-hydroxy-7-methyl-1-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-[(4-hydroxybenzoyl)oxymethyl]oxan-2-yl]oxy-4a,5,6,7a-tetrahydro-1H-cyclopenta[c]pyran-4-carboxylic acid C23H28O12
[4-[(2S,3R,4S,5R,6R)-2,3,4,5-tetraacetyloxy-6-(hydroxymethyl)oxan-2-yl]phenyl]methyl acetate C23H28O12
(2S,3S,4S,5R,6S)-6-[[5-[(E)-5-carboxy-3-methylpent-2-enyl]-6-methoxy-7-methyl-3-oxo-1H-2-benzofuran-4-yl]oxy]-3,4,5-trihydroxyoxane-2-carboxylic acid C23H28O12
(2S,3S,4S,5R,6S)-3,4,5-trihydroxy-6-[(E)-6-(4-hydroxy-6-methoxy-7-methyl-3-oxo-1H-2-benzofuran-5-yl)-4-methylhex-4-enoyl]oxyoxane-2-carboxylic acid C23H28O12
[(1S,2S,4S,5S,6R,10S)-2-(hydroxymethyl)-10-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3,9-dioxatricyclo[4.4.0.02,4]dec-7-en-5-yl] 4-methoxybenzoate C23H28O12
[(1S,4aR,5S,7aS)-5-hydroxy-1-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-1,4a,5,7a-tetrahydrocyclopenta[c]pyran-7-yl]methyl 4-hydroxy-3-methoxybenzoate C23H28O12
6-(3-hydroxybenzoyl)oxy-7-methyl-1-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-1,4a,5,6,7,7a-hexahydrocyclopenta[c]pyran-4-carboxylic acid C23H28O12

Also listed as

Oxypaeoniflorin/ 99.72% (existing batch purity) TargetMol CAS 39011-91-1
Oxypaeoniflorin (Standard) MedChemExpress CAS 39011-91-1
Oxypaeoniflorin, 99.14% MedChemExpress CAS 39011-91-1