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Ergoline-8-carboxamide,9,10-didehydro-N-[(1S)-1-[[(3S,8aR)-hexahydro-1,4-dioxo-3-(phenylmethyl)pyrrolo[1,2-a]pyrazin-2(3H)-yl]carbonyl]-2-methylpropyl]-6-methyl-,(8b)- (50868-53-6)

Identification
Name:Ergoline-8-carboxamide,9,10-didehydro-N-[(1S)-1-[[(3S,8aR)-hexahydro-1,4-dioxo-3-(phenylmethyl)pyrrolo[1,2-a]pyrazin-2(3H)-yl]carbonyl]-2-methylpropyl]-6-methyl-,(8b)-
Synonyms:1',12'-Secoergotaman-3',6',12',18-tetrone,2'-deoxy-2'-(1-methylethyl)-5'-(phenylmethyl)-, (2'S,5'a,11'a)-; Ergocristam;N-(D-Lysergyl-L-valyl)-cyclo(L-phenylalanyl-D-prolyl);N-[N-(d-Lysergyl-L-valyl]-L-phenylalanyl-D-proline lactam; [8b[1S(3S,8aR)]]-9,10-Didehydro-N-[1-[[hexahydro-1,4-dioxo-3-(phenylmethyl)pyrrolo[1,2-a]pyrazin-2(1H)-yl]carbonyl]-2-methylpropyl]-6-methylergoline-8-carboxamide
CAS:50868-53-6
Molecular Formula: C35H39 N5 O4
Molecular Weight: 593.7153
InChI: InChI=1/C35H39N5O4/c1-20(2)31(35(44)40-29(15-21-9-5-4-6-10-21)33(42)39-14-8-13-27(39)34(40)43)37-32(41)23-16-25-24-11-7-12-26-30(24)22(18-36-26)17-28(25)38(3)19-23/h4-7,9-12,16,18,20,23,27-29,31,36H,8,13-15,17,19H2,1-3H3,(H,37,41)
Molecular Structure: (C35H39N5O4) 1',12'-Secoergotaman-3',6',12',18-tetrone,2'-deoxy-2'-(1-methylethyl)-5'-(phenylmethyl)-, (2'S,5'a,1...
Properties
Flash Point: 484.1°C
Boiling Point: 876.9°C at 760 mmHg
Density:1.35g/cm3
Refractive index:1.688
Flash Point: 484.1°C
Safety Data
 

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