| Identification | |
| Name: | 5'-[(2S)-butan-2-yl]-2'-ethyl-12'-hydroxy-3',6',18-trioxoergotaman |
| Synonyms: | AC1L57ZV;65756-55-0;LS-64526;Ergotaman-3',6',18-trione, 2'-ethyl-12'-hydroxy-5'-(1-methylpropyl)-, (5'-alpha(S))-;Ergotaman-3',6',18-trione, 2'-ethyl-12'-hydroxy-5'-(1-methylpropyl)-, (5'-alpha(S))- (9CI) |
| CAS: | 65756-55-0 |
| Molecular Formula: | C31H39N5O5 |
| Molecular Weight: | 561.6719 |
| InChI: | InChI=1/C31H39N5O5/c1-5-17(3)26-28(38)35-12-8-11-24(35)31(40)36(26)29(39)30(6-2,41-31)33-27(37)19-13-21-20-9-7-10-22-25(20)18(15-32-22)14-23(21)34(4)16-19/h7,9-10,13,15,17,19,23-24,26,32,40H,5-6,8,11-12,14,16H2,1-4H3,(H,33,37)/t17-,19+,23+,24-,26?,30+,31-/m0/s1 |
| Molecular Structure: |  |
| Properties | |
| Flash Point: | 476.2°C |
| Boiling Point: | 863.8°C at 760 mmHg |
| Density: | 1.4g/cm3 |
| Refractive index: | 1.69 |
| Flash Point: | 476.2°C |
| Safety Data | |
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