CAS Number27548-93-2
SynonymsBaccatin III; MFCD00153921; (2α,5β,7β,10β,13α)-4,10-Diacetoxy-1,7,13-trihydroxy-9-oxo-5,20-epoxytax-11-en-2-yl benzoate
Molecular FormulaC31H38O11
Molecular Weight586.627
Purity98.00%
Density1.4±0.1 g/cm3
Boiling Point713.6±60.0 °C at 760 mmHg
Melting Point229-234 °C
AppearanceWhite to off-white powder
Symbol
Signal WordWarning
| Chemical & Physical Properties | |
|---|---|
| CAS Number | 27548-93-2 |
| Catalog No. | 2A-9040222 |
| Chinese Name | 巴卡丁III |
| Synonyms | Baccatin III; MFCD00153921; (2α,5β,7β,10β,13α)-4,10-Diacetoxy-1,7,13-trihydroxy-9-oxo-5,20-epoxytax-11-en-2-yl benzoate |
| Molecular Formula | C31H38O11 |
| Molecular Weight | 586.627 |
| Purity | 98.00 |
| Density | 1.4±0.1 g/cm3 |
| Boiling Point | 713.6±60.0 °C at 760 mmHg |
| Melting Point | 229-234 °C |
| Appearance | White to off-white powder |
| Water Solubility | Insoluble |
| Storage Condition | 2-8℃ |
| Packaging | III |
| Application | Baccatin III is a natural product isolated from the Pacific yew tree and its relatives. Baccatin III can delay tumor development by reducing the accumulation of MDSCs and inhibiting their function. |
| SMILES | CC(=O)OC1C(=O)C2(C)C(O)CC3OCC3(OC(C)=O)C2C(OC(=O)c2ccccc2)C2(O)CC(O)C(C)=C1C2(C)C |
| InChI | InChI=1S/C31H38O11/c1-15-19(34)13-31(38)26(41-27(37)18-10-8-7-9-11-18)24-29(6,20(35)12-21-30(24,14-39-21)42-17(3)33)25(36)23(40-16(2)32)22(15)28(31,4)5/h7-11,19-21,23-24,26,34-35,38H,12-14H2,1-6H3/t19-,20-,21+,23+,24-,26-,29+,30-,31+/m0/s1 |
| InChI Key | OVMSOCFBDVBLFW-VHLOTGQHSA-N |
| Hazard Symbols | 6.1(b) |
| Bioactivity | Chemical & Physical Properties |
| Use of | Baccatin III is a natural product isolated from Pacific yew tree and related species. Baccatin III reduces tumor progression by inhibiting the accumulation and suppressive function of MDSCs[1]. Properties Biological Activity Chemical & Physical Properties |
| Transport Info | Product name: Purity: 98.0% |
| MSDS Transport Info | Module 14. Shipping information 14.1 UN dangerous goods number European Land Transport Dangerous Regulations: -International Maritime Dangerous Regulations: -International Air Transport Dangerous Regulations: - 14.2 Names specified by the United Nations (UN) European Land Transport Dangerous Regulations: Non-dangerous goods IMDG Code: Non-dangerous goods International air transport dangerous goods regulations: non-dangerous goods 14.3 Transport hazard categories European Land Transport Dangerous Regulations: -International Maritime Dangerous Regulations: -International Air Transport Dangerous Regulations: - 14.4 Package group European Land Transport Dangerous Regulations: -International Maritime Dangerous Regulations: -International Air Transport Dangerous Regulations: - 14.5 Environmental hazards European Land Transport Dangerous Regulations: No International Maritime Transport Dangerous Regulations Maritime Pollutants: No International Air Transport Risk Regulations: No 14.6 Special reminder to users No data available See reverse side of invoice or packing slip. |
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