(5alpha,5'beta)-5'-[(2S)-butan-2-yl]-12'-hydroxy-2'-methyl-3',6',18-trioxoergotaman (65794-74-3)

Identification
Name:	(5alpha,5'beta)-5'-[(2S)-butan-2-yl]-12'-hydroxy-2'-methyl-3',6',18-trioxoergotaman
Synonyms:	AC1L4B3H;65794-74-3
CAS:	65794-74-3
Molecular Formula:	C₃₀H₃₇N₅O₅
Molecular Weight:	547.6453
InChI:	InChI=1/C30H37N5O5/c1-5-16(2)25-27(37)34-11-7-10-23(34)30(39)35(25)28(38)29(3,40-30)32-26(36)18-12-20-19-8-6-9-21-24(19)17(14-31-21)13-22(20)33(4)15-18/h6,8-9,12,14,16,18,22-23,25,31,39H,5,7,10-11,13,15H2,1-4H3,(H,32,36)/t16-,18+,22-,23-,25+,29+,30-/m0/s1
Molecular Structure:
Properties
Flash Point:	474.6°C
Boiling Point:	861.1°C at 760 mmHg
Density:	1.42g/cm³
Refractive index:	1.699
Flash Point:	474.6°C
Safety Data

Other Product

(5alpha,5'beta)-5'-[(2S)-butan-2-yl]-2'-ethyl-12'-hydroxy-3',6',18-trioxoergotaman
5'-[(2S)-butan-2-yl]-2'-ethyl-12'-hydroxy-3',6',18-trioxoergotaman
(5alpha,5'alpha)-12'-hydroxy-2'-methyl-5'-(1-methylethyl)-3',6',18-trioxoergotaman
(5alpha,5'alpha)-5'-benzyl-12'-hydroxy-2'-methyl-3',6',18-trioxoergotaman - (5'alpha)-5'-benzyl-12'-hydroxy-2'-methyl-3',6',18-trioxoergotaman (1:1)
(5alpha,5'alpha)-12'-hydroxy-2'-methyl-5'-(2-methylpropyl)-3',6',18-trioxoergotaman methanesulfonate (1:1)
(5'beta)-2',5'-diethyl-12'-hydroxy-3',6',18-trioxoergotaman
(5'beta)-5'-benzyl-2'-ethyl-12'-hydroxy-3',6',18-trioxoergotaman
(5'alpha)-2-bromo-12'-hydroxy-2'-methyl-5'-(2-methylpropyl)-3',6',18-trioxoergotaman
(5'alpha)-5'-benzyl-12'-hydroxy-2'-methyl-3',6',18-trioxoergotaman 2,3-dihydroxybutanedioate (1:1)
(5'alpha)-5'-benzyl-12'-hydroxy-2'-methyl-3',6',18-trioxoergotaman methanesulfonate (1:1)
(5alpha,8alpha)-12'-hydroxy-3',6',18-trioxoergotaman
(5'alpha)-12'-hydroxy-2'-(1-methylethyl)-5'-(2-methylpropyl)-3',6',18-trioxoergotaman 2,3-dihydroxybutanedioate (salt)
5'-(butan-2-yl)-12'-hydroxy-3',6',18-trioxo-2'-(propan-2-yl)ergotaman
(5'beta)-5'-ethyl-12'-hydroxy-3',6',18-trioxo-2'-(propan-2-yl)ergotaman
(5alpha,8xi,9xi,12alpha,13xi,14beta)-12-hydroxy-17-[(2S)-2-hydroxy-6-methylhept-5-en-2-yl]-4,4,5,10,14-pentamethylgonan-3-yl 2-O-(6-O-acetyl-beta-D-glucopyranosyl)-beta-D-glucopyranoside
Ergotaman-3',6',18-trione,12'-hydroxy-2'-methyl-5'-(2-methylpropyl)-, (5'a)-
Ergotaman-3',6',18-trione,12'-hydroxy-2'-methyl-5'-(2-methylpropyl)-, (5'a,8a)-
(5'alpha,10alpha)-12'-hydroxy-2'-methyl-5'-(2-methylpropyl)-3',6',18-trioxo-9,10-dihydroergotaman
Ergotaman-3',6',18-trione,12'-hydroxy-2'- methyl-5'-(1-methylethyl)-,(2'â,5'R)-
Ergotaman-3',6',18-trione,12'-hydroxy-2'- methyl-5'-(phenylmethyl)-,(2'â,5'R)-