Taxayunnansin A structure
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Common Name | Taxayunnansin A | ||
|---|---|---|---|---|
| CAS Number | 153229-31-3 | Molecular Weight | 672.716 | |
| Density | 1.3±0.1 g/cm3 | Boiling Point | 720.3±60.0 °C at 760 mmHg | |
| Molecular Formula | C35H44O13 | Melting Point | N/A | |
| MSDS | N/A | Flash Point | 218.4±26.4 °C | |
Use of Taxayunnansin ATaxayuntin (Taxayunnansin A; 13-Decinnamoyltaxchinin B) is a taxane diterpenoid isolated from Taxus yunnanensis[1]. |
| Name | (2aR,4S,4aS,5R,6R,8S,9aS,10S,10aR,10bS)-6-(benzoyloxy)-8-hydroxy-9a-(2-hydroxypropan-2-yl)-4a,7-dimethyl-3,4,4a,5,6,8,9,9a,10,10a-decahydro-1H-azuleno[5',6':3,4]benzo[1,2-b]oxete-4,5,10,10b(2aH)-tetrayl tetraacetate |
|---|---|
| Synonym | More Synonyms |
| Description | Taxayuntin (Taxayunnansin A; 13-Decinnamoyltaxchinin B) is a taxane diterpenoid isolated from Taxus yunnanensis[1]. |
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| Related Catalog | |
| References |
[1]. Zhang H, et al. Taxanes from Taxus yunnanensis[J]. Phytochemistry, 1995, 39(5): 1147-1151. |
| Density | 1.3±0.1 g/cm3 |
|---|---|
| Boiling Point | 720.3±60.0 °C at 760 mmHg |
| Molecular Formula | C35H44O13 |
| Molecular Weight | 672.716 |
| Flash Point | 218.4±26.4 °C |
| Exact Mass | 672.278198 |
| PSA | 181.19000 |
| LogP | 3.85 |
| Vapour Pressure | 0.0±2.4 mmHg at 25°C |
| Index of Refraction | 1.581 |
| InChIKey | IKDVXNASCSGIHM-SZBOGCPYSA-N |
| SMILES | CC(=O)OC1CC2OCC2(OC(C)=O)C2C(OC(C)=O)C3(C(C)(C)O)CC(O)C(C)=C3C(OC(=O)c3ccccc3)C(OC(C)=O)C12C |
| Hazard Codes | Xi |
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Name: Cytotoxicity against murine leukemia L1210 cells
Source: ChEMBL
Target: L1210
External Id: CHEMBL820543
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Name: Vincristine (VCR) accumulation in multidrug resistant human ovarian cancer 2780 AD ce...
Source: ChEMBL
Target: N/A
External Id: CHEMBL842637
|
|
Name: Vincristine (VCR) accumulation in multidrug resistant human ovarian cancer 2780 AD ce...
Source: ChEMBL
Target: N/A
External Id: CHEMBL842636
|
|
Name: Cytotoxicity against human epidermoid carcinoma KB cells
Source: ChEMBL
Target: N/A
External Id: CHEMBL700546
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| (2aR,4S,4aS,5R,6R,8S,9aS,10S,10aR,10bS)-4,5,10,10b-tetrakis(acetyloxy)-8-hydroxy-9a-(2-hydroxypropan-2-yl)-4a,7-dimethyl-2a,3,4,4a,5,6,8,9,9a,10,10a,10b-dodecahydro-1H-azuleno[5',6':3,4]benzo[1,2-b]oxet-6-yl benzoate |
| (2aR,4S,4aS,5R,6R,8S,9aS,10S,10aR,10bS)-4,5,10,10b-Tetraacetoxy-8-hydroxy-9a-(2-hydroxy-2-propanyl)-4a,7-dimethyl-2a,3,4,4a,5,6,8,9,9a,10,10a,10b-dodecahydro-1H-azuleno[5',6':3,4]benzo[1,2-b]oxet-6-yl benzoate |