
| Chemical & Physical Properties | |
|---|---|
| CAS Number | 77181-26-1 |
| Catalog No. | 2A-9048090 |
| Chinese Name | 3-乙酰乌头碱 |
| Synonyms | 3-acetylaconitine; Flaconitine |
| Molecular Formula | C36H49NO12 |
| Molecular Weight | 687.774 |
| Purity | 98.00 |
| Density | 1.4±0.1 g/cm3 |
| Boiling Point | 715.9±60.0 °C at 760 mmHg |
| Storage Condition | Warehouse is low temperature, ventilated and dry |
| Application | Flaconitine is an alkaloid isolated from the roots of A.szechenyianum. Flaconitine is an NF-κB inhibitor. |
| PubChem ID | 319429547 |
| SMILES | CCN1CC2(COC)C(OC(C)=O)CC(OC)C34C5CC6(O)C(OC)C(O)C(OC(C)=O)(C5C6OC(=O)c5ccccc5)C(C(OC)C23)C14 |
| InChI | InChI=1S/C36H49NO12.BrH/c1-8-37-16-33(17-43-4)22(47-18(2)38)14-23(44-5)35-21-15-34(42)30(48-32(41)20-12-10-9-11-13-20)24(21)36(49-19(3)39,29(40)31(34)46-7)25(28(35)37)26(45-6)27(33)35;/h9-13,21-31,40,42H,8,14-17H2,1-7H3;1H/t21-,22?,23?,24-,25?,26?,27-,28-,29?,30?,31?,33?,34-,35?,36-;/m1./s1 |
| InChI Key | RIPYIJVYDYCPKW-LFNWZUEYSA-N |
| Transport Info | Product Name: Acetyl Aconitine |
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