CAS 38642-49-8|Benzoylpaeoniflorin

Introduction:Basic information about CAS 38642-49-8|Benzoylpaeoniflorin, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
Common NameBenzoylpaeoniflorin
CAS Number38642-49-8Molecular Weight584.568
Density1.6±0.1 g/cm3Boiling Point742.9±60.0 °C at 760 mmHg
Molecular FormulaC30H32O12Melting Point/
MSDS/Flash Point243.1±26.4 °C

Names

Namebenzoylpaeoniflorin
SynonymMore Synonyms

Benzoylpaeoniflorin BiologicalActivity

DescriptionBenzoylpaeoniflorin is a natural product; may treat coronary heart disease by decreasing apoptosis.
Related CatalogSignaling Pathways >>Others >>OthersNatural Products >>Terpenoids and GlycosidesResearch Areas >>Cardiovascular Disease
References

[1]. Xinfeng Zhao, et al. Quantitative and Qualitative Determination of Liuwei Dihuang Tablets by HPLC–UV-MS–MS. Journal of Chromatographic Science, Vol. 45, September 2007, 549-552

[2]. ZHANG Er-li, et al. Effects of Benzoylpaeoniflorin on apoptosis of Rats with Coronary Heart Diseases. Chinese Journal of Laboratory Diagnosis, 2011-04.

Chemical & Physical Properties

Density1.6±0.1 g/cm3
Boiling Point742.9±60.0 °C at 760 mmHg
Molecular FormulaC30H32O12
Molecular Weight584.568
Flash Point243.1±26.4 °C
Exact Mass584.189392
PSA170.44000
LogP5.55
Vapour Pressure0.0±2.6 mmHg at 25°C
Index of Refraction1.682
InChIKeyLATYEZNGPQKAIK-NHNUMYDTSA-N
SMILESCC12CC3(O)OC(O1)C1(COC(=O)c4ccccc4)C3CC21OC1OC(COC(=O)c2ccccc2)C(O)C(O)C1O

Safety Information

Hazard CodesXi

Synonyms

{(3S,5R,6S)-1-({[(4,5-Dihydroxy-2-cyclohexen-1-yl)carbonyl]oxy}methyl)-3-[(1aR)-1H-3,4-dioxacyclobuta[cd]pentalen-1a(2H)-yloxy]-5,6-dihydroxy-4-methyl-2-oxabicyclo[2.2.1]hept-3-yl}methyl benzoate
2-Cyclohexene-1-carboxylic acid, 4,5-dihydroxy-, [(3S,5R,6S)-3-[(benzoyloxy)methyl]-3-[(1aR)-1H-3,4-dioxacyclobuta[cd]pentalen-1a(2H)-yloxy]-5,6-dihydroxy-4-methyl-2-oxabicyclo[2.2.1]hept-1-yl]methyl ester
β-D-Glucopyranoside, (1aR,2S,3aR,5R,5aR,5bS)-5b-[(benzoyloxy)methyl]tetrahydro-5-hydroxy-2-methyl-2,5-methano-1H-3,4-dioxacyclobuta[cd]pentalen-1a(2H)-yl, 6-benzoate
Enzoylaconitine
{(1R,2S,3R,5R,6R,8S)-3-[(6-O-Benzoyl-β-D-glucopyranosyl)oxy]-6-hydroxy-8-methyl-9,10-dioxatetracyclo[4.3.1.0.0]dec-2-yl}methyl benzoate
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