| Identification | |
| Name: | (5'alpha,8xi,11'alpha)-2'-ethyl-12'-hydroxy-5'-methyl-3',6',18-trioxo-5'-phenylergotaman |
| Synonyms: | Ergostinine;AC1MJ1AT;Ergotaman-3',6',8-trione, 2'-ethyl-12'-hydroxy-5'-(phenylmethyl)-, (5'alpha,8alpha)-;3268-95-9 |
| CAS: | 3268-95-9 |
| Molecular Formula: | C34H37N5O5 |
| Molecular Weight: | 595.6881 |
| InChI: | InChI=1/C34H37N5O5/c1-4-33(36-29(40)21-16-24-23-12-8-13-25-28(23)20(18-35-25)17-26(24)37(3)19-21)31(42)39-32(2,22-10-6-5-7-11-22)30(41)38-15-9-14-27(38)34(39,43)44-33/h5-8,10-13,16,18,21,26-27,35,43H,4,9,14-15,17,19H2,1-3H3,(H,36,40)/t21?,26-,27-,32+,33-,34+/m1/s1 |
| Molecular Structure: |  |
| Properties | |
| Flash Point: | 504.1°C |
| Boiling Point: | 909.9°C at 760 mmHg |
| Density: | 1.45g/cm3 |
| Refractive index: | 1.733 |
| Flash Point: | 504.1°C |
| Safety Data | |
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