Introduction：Basic information about CAS 1260252-18-3|3-O-beta-Allopyranosyl-(1->4)-beta-oleandropyranosyl-11-O-isobutyryl-12-O-acetyl, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
| Common Name | 3-O-beta-Allopyranosyl-(1->4)-beta-oleandropyranosyl-11-O-isobutyryl-12-O-acetyltenacigenin B |
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| CAS Number | 1260252-18-3 | Molecular Weight | 780.938 |
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| Density | 1.3±0.1 g/cm3 | Boiling Point | 807.6±65.0 °C at 760 mmHg |
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| Molecular Formula | C41H64O14 | Melting Point | / |
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| MSDS | / | Flash Point | 234.9±27.8 °C |
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Names
| Name | (3β,5α,11α,12β,14β,17α)-12-acetyloxy-3-[(2,6-dideoxy-4-O-(6-deoxy-3-O-methyl-β-D-allopyranosyl)-3-O-methyl-β-D-arabino-hexopyranosyl)oxy]-20-oxo-8,14-epoxypregnan-11-yl isobutyrate |
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| Synonym | More Synonyms |
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BiologicalActivity
| Description | 3-O-beta-Allopyranosyl-(1->4)-beta-oleandropyranosyl-11-O-isobutyryl-12-O-acetyltenacigenin B is a chemical constituent of the plant Poria cocos [1]. |
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| Related Catalog | Research Areas >>OthersSignaling Pathways >>Others >>Others |
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| References | [1]. Hu YJ, et al. Tenacigenin B derivatives reverse P-glycoprotein-mediated multidrug resistance inHepG2/Dox cells. J Nat Prod. 2008 Jun;71(6):1049-51. |
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Chemical & Physical Properties
| Density | 1.3±0.1 g/cm3 |
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| Boiling Point | 807.6±65.0 °C at 760 mmHg |
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| Molecular Formula | C41H64O14 |
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| Molecular Weight | 780.938 |
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| Flash Point | 234.9±27.8 °C |
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| Exact Mass | 780.429626 |
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| PSA | 178.04000 |
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| LogP | 4.20 |
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| Vapour Pressure | 0.0±6.5 mmHg at 25°C |
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| Index of Refraction | 1.553 |
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| InChIKey | DAXMBTMYJCYTRG-IRCPNMLKSA-N |
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| SMILES | COC1CC(OC2CCC3(C)C(CCC45OC46CCC(C(C)=O)C6(C)C(OC(C)=O)C(OC(=O)C(C)C)C35)C2)OC(C)C1OC1OC(C)C(O)C(OC)C1O |
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Synonyms
| Tenacigenin B, 3-O-Beta-Allopyranosyl-(1→4)-Beta-oleandropyranosyl-11-O-isobutyryl-12-O-acetyl- |
| Propanoic acid, 2-methyl-, (3β,11α,12β,13ξ,14β,17α)-12-(acetyloxy)-3-[[2,6-dideoxy-4-O-(6-deoxy-3-O-methyl-D-allopyranosyl)-3-O-methyl-β-D-arabino-hexopyranosyl]oxy]-8,14-epoxy-20 -oxopregnan-11-yl ester |
| (3β,11α,12β,13ξ,14β,17α)-12-Acetoxy-3-{[2,6-dideoxy-4-O-(6-deoxy-3-O-methyl-D-allopyranosyl)-3-O-methyl-β-D-arabino-hexopyranosyl]oxy}-20-oxo-8,14-epoxypregnan-11-yl 2-methylpropa noate |
