
| Chemical & Physical Properties | |
|---|---|
| CAS Number | 87178-42-5 |
| Catalog No. | 2A-9010237 |
| Chinese Name | 度麦角胺 |
| Synonyms | Dosergoside; UNII-S8674EHG6Y; Dosergoside [INN] |
| Molecular Formula | C34H53N3O3 |
| Molecular Weight | 551.80300 |
| Purity | 98.00 |
| Density | 1.094g/cm3 |
| Boiling Point | 771.2ºC at 760mmHg |
| SMILES | CCCCCCCCCCCCCC=CC(O)C(CO)NC(=O)C1CC2c3cccc4[nH]cc(c34)CC2N(C)C1 |
| InChI | InChI=1S/C34H53N3O3/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-19-32(39)30(24-38)36-34(40)26-20-28-27-17-16-18-29-33(27)25(22-35-29)21-31(28)37(2)23-26/h15-19,22,26,28,30-32,35,38-39H,3-14,20-21,23-24H2,1-2H3,(H,36,40)/b19-15+/t26-,28?,30+,31-,32-/m1/s1 |
| InChI Key | DIPBYRMTSXMCIM-JSXVGJAVSA-N |
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