Introduction:Basic information about CAS 38642-49-8|Benzoylpaeoniflorin, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
| Common Name | Benzoylpaeoniflorin |
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| CAS Number | 38642-49-8 | Molecular Weight | 584.568 |
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| Density | 1.6±0.1 g/cm3 | Boiling Point | 742.9±60.0 °C at 760 mmHg |
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| Molecular Formula | C30H32O12 | Melting Point | / |
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| MSDS | / | Flash Point | 243.1±26.4 °C |
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Names
| Name | benzoylpaeoniflorin |
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| Synonym | More Synonyms |
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Benzoylpaeoniflorin BiologicalActivity
| Description | Benzoylpaeoniflorin is a natural product; may treat coronary heart disease by decreasing apoptosis. |
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| Related Catalog | Signaling Pathways >>Others >>OthersNatural Products >>Terpenoids and GlycosidesResearch Areas >>Cardiovascular Disease |
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| 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. |
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Chemical & Physical Properties
| Density | 1.6±0.1 g/cm3 |
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| Boiling Point | 742.9±60.0 °C at 760 mmHg |
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| Molecular Formula | C30H32O12 |
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| Molecular Weight | 584.568 |
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| Flash Point | 243.1±26.4 °C |
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| Exact Mass | 584.189392 |
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| PSA | 170.44000 |
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| LogP | 5.55 |
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| Vapour Pressure | 0.0±2.6 mmHg at 25°C |
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| Index of Refraction | 1.682 |
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| InChIKey | LATYEZNGPQKAIK-NHNUMYDTSA-N |
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| SMILES | CC12CC3(O)OC(O1)C1(COC(=O)c4ccccc4)C3CC21OC1OC(COC(=O)c2ccccc2)C(O)C(O)C1O |
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Safety Information
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 |