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Updated CAS


   ChemNet > CAS > 3398-46-7 (5'alpha)-12'-hydroxy-2'-methyl-3',6',18-trioxo-5'-(propan-2-yl)ergotaman methanesulfonate (1:1)

3398-46-7 (5'alpha)-12'-hydroxy-2'-methyl-3',6',18-trioxo-5'-(propan-2-yl)ergotaman methanesulfonate (1:1)

product Name (5'alpha)-12'-hydroxy-2'-methyl-3',6',18-trioxo-5'-(propan-2-yl)ergotaman methanesulfonate (1:1)
CAS No 3398-46-7
Synonyms
Molecular Formula C30H39N5O8S
Molecular Weight 629.7244
InChI InChI=1/C29H35N5O5.CH4O3S/c1-15(2)24-26(36)33-10-6-9-22(33)29(38)34(24)27(37)28(3,39-29)31-25(35)17-11-19-18-7-5-8-20-23(18)16(13-30-20)12-21(19)32(4)14-17;1-5(2,3)4/h5,7-8,11,13,15,17,21-22,24,30,38H,6,9-10,12,14H2,1-4H3,(H,31,35);1H3,(H,2,3,4)/t17-,21-,22+,24+,28-,29+;/m1./s1
Molecular Structure 3398-46-7 (5'alpha)-12'-hydroxy-2'-methyl-3',6',18-trioxo-5'-(propan-2-yl)ergotaman methanesulfonate (1:1)
Boiling point 859.1°C at 760 mmHg
Flash point 473.4°C
Vapour Pressur 1.87E-31mmHg at 25°C
Hazard Symbols
Risk Codes
Safety Description