Ergotaman-3',6',18-trione,12'-hydroxy-2',5'-bis(1-methylethyl)-, (5'a,8a)- (564-37-4)

Identification
Name:	Ergotaman-3',6',18-trione,12'-hydroxy-2',5'-bis(1-methylethyl)-, (5'a,8a)-
Synonyms:	Ergocorninine(6CI,7CI,8CI); 8H-Oxazolo[3,2-a]pyrrolo[2,1-c]pyrazine, ergotaman-3',6',18-trionederiv.; Indolo[4,3-fg]quinoline, ergotaman-3',6',18-trione deriv.;8-Epiergocornine; 8-Isoergocornine
CAS:	564-37-4
EINECS:	209-273-2
Molecular Formula:	C31H39 N5 O5
Molecular Weight:	561.67186
InChI:	InChI=1/C31H39N5O5/c1-16(2)26-28(38)35-11-7-10-24(35)31(40)36(26)29(39)30(41-31,17(3)4)33-27(37)19-12-21-20-8-6-9-22-25(20)18(14-32-22)13-23(21)34(5)15-19/h6,8-9,12,14,16-17,19,23-24,26,32,40H,7,10-11,13,15H2,1-5H3,(H,33,37)/t19-,23+,24-,26-,30+,31-/m0/s1
Molecular Structure:
Properties
Transport:	1544
Flash Point:	472.874°C
Boiling Point:	858.285°C at 760 mmHg
Density:	1.402g/cm³
Refractive index:	1.689
Packinggroup:	III
Flash Point:	472.874°C
Safety Data