CAS 39011-91-1|Oxypaeoniflorin

Introduction:Basic information about CAS 39011-91-1|Oxypaeoniflorin, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
Common NameOxypaeoniflorin
CAS Number39011-91-1Molecular Weight496.461
Density1.7±0.1 g/cm3Boiling Point737.1±60.0 °C at 760 mmHg
Molecular FormulaC23H28O12Melting Point/
MSDS/Flash Point254.6±26.4 °C

Names

Nameoxypaeoniflora
SynonymMore Synonyms

Oxypaeoniflorin BiologicalActivity

DescriptionOxypaeoniflorin is a natural product derived from Radix Paeoniae Rubra and Radix Paeoniae Alba.
Related CatalogSignaling Pathways >>Others >>OthersResearch Areas >>OthersNatural Products >>Terpenoids and Glycosides
References

[1]. M. Kaneda, Chemical studies on the oriental plant drugs—XXXIII : The absolute structures of paeoniflorin, albiflorin, oxypaeoniflorin and benzoylpaeoniflorin isolated from chinese paeony root. Tetrahedron Volume 28, Issue 16, 1972, Pages 4309-4317

[2]. Feng C, et al. Pharmacokinetic properties of paeoniflorin, albiflorin and oxypaeoniflorin after oral gavage of extracts of Radix Paeoniae Rubra and Radix Paeoniae Alba in rats. J Ethnopharmacol. 2010 Jul 20;130(2):407-13.

Chemical & Physical Properties

Density1.7±0.1 g/cm3
Boiling Point737.1±60.0 °C at 760 mmHg
Molecular FormulaC23H28O12
Molecular Weight496.461
Flash Point254.6±26.4 °C
Exact Mass496.158081
PSA184.60000
LogP-0.17
Vapour Pressure0.0±2.5 mmHg at 25°C
Index of Refraction1.708
InChIKeyFCHVXNVDFYXLIL-WRJNSLSBSA-N
SMILESCC12CC3(O)OC(O1)C1(COC(=O)c4ccc(O)cc4)C3CC21OC1OC(CO)C(O)C(O)C1O
Storage condition-20°C

Synonyms

[(1R,2S,3R,5R,6R,8S)-3-(β-D-Glucopyranosyloxy)-6-hydroxy-8-methyl-9,10-dioxatetracyclo[4.3.1.0.0]dec-2-yl]methyl 4-hydroxybenzoate
[(1aR,2S,3aR,5R,5aR,5bS)-1a-(β-D-glucopyranosyloxy)-5-hydroxy-2-methyltetrahydro-1H-2,5-methano-3,4-dioxacyclobuta[cd]pentalen-5b(3aH)-yl]methyl 4-hydroxybenzoate
oxypaeoniflorin
Benzoic acid, 4-hydroxy-, [(1aR,2S,3aR,5R,5aR,5bS)-1a-(β-D-glucopyranosyloxy)tetrahydro-5-hydroxy-2-methyl-2,5-methano-1H-3,4-dioxacyclobuta[cd]pentalen-5b(3aH)-yl]methyl ester
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