20315-46-2, CAS No 20315-46-2

20315-46-2 5'α(S)-sec-butyl-12'-hydroxy-2'-isopropylergotaman-3',6',18-trione
Product Name	5'α(S)-sec-butyl-12'-hydroxy-2'-isopropylergotaman-3',6',18-trione
Synonyms	beta-Ergocryptine;beta-Ergokryptine;5'alpha(S)-sec-Butyl-12'-hydroxy-2'-isopropylergotaman-3',6',18-trione;(5'beta)-5'-[(2S)-butan-2-yl]-12'-hydroxy-3',6',18-trioxo-2'-(propan-2-yl)ergotaman
Molecular Formula	C₃₂H₄₁N₅O₅
Molecular Weight	575.6984
InChl	InChI=1/C32H41N5O5/c1-6-18(4)27-29(39)36-12-8-11-25(36)32(41)37(27)30(40)31(42-32,17(2)3)34-28(38)20-13-22-21-9-7-10-23-26(21)19(15-33-23)14-24(22)35(5)16-20/h7,9-10,13,15,17-18,20,24-25,27,33,41H,6,8,11-12,14,16H2,1-5H3,(H,34,38)/t18-,20+,24+,25-,27+,31+,32-/m0/s1
CAS Registry Number	20315-46-2
EINECS	243-728-6
Molecular Structure
Density	1.38g/cm³
Boiling Point	861.5°C at 760 mmHg
Refractive Index	1.68
Flash Point	474.8°C
Vapour Pressur	1.21E-31mmHg at 25°C

20315-46-2 5'α(S)-sec-butyl-12'-hydroxy-2'-isopropylergotaman-3',6',18-trione