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

5'alpha(S)-sec-butyl-12'-hydroxy-2'-isopropylergotaman-3',6',18-trione Structure
CAS No.
20315-46-2
Chemical Name:
5'alpha(S)-sec-butyl-12'-hydroxy-2'-isopropylergotaman-3',6',18-trione
Synonyms
β-Ergocryptine;b-Ergocryptine;-β-Ergocryptine;beta-ergocryptine;Hybutimibe Impurity 27;Bromocriptine Impurity 1;Bromocriptine Impurity 20 (β-Ergocryptine);5'alpha(S)-sec-butyl-12'-hydroxy-2'-isopropylergotaman-3',6',18-trione;12'-Hydroxy-2'-isopropyl-5'α-[(S)-1-methylpropyl]ergotaman-3',6',18-trione;[5'α(S)]-12'-Hydroxy-2'-(1-Methylethyl)-5'-(1-Methylpropyl)ergotaMan-3',6',18-trione
CBNumber:
CB7935756
Molecular Formula:
C32H41N5O5
Molecular Weight:
575.7
MOL File:
20315-46-2.mol
Modify Date:
2023/4/20 16:15:45

5'alpha(S)-sec-butyl-12'-hydroxy-2'-isopropylergotaman-3',6',18-trione Properties

Melting point 173° (dec)
alpha D20 -98° (c = 0.5 in pyridine); -179° (c = 0.5 in chloroform)
Boiling point 861.5±65.0 °C(Predicted)
Density 1.38±0.1 g/cm3(Predicted)
pka 9.61±0.60(Predicted)

SAFETY

Risk and Safety Statements

RIDADR  1544
HazardClass  6.1(b)
PackingGroup  III
Toxicity rabbit,LD50,intravenous,125mg/kg (125mg/kg),Experientia. Vol. 33, Pg. 1552, 1977.

5'alpha(S)-sec-butyl-12'-hydroxy-2'-isopropylergotaman-3',6',18-trione Chemical Properties,Uses,Production

Uses

β-Ergocryptine is an ergopeptine and one of the ergot alkaloids. α-Ergocryptine and β-Ergocryptine are ergot alkaloid impurities in Abergin.

5'alpha(S)-sec-butyl-12'-hydroxy-2'-isopropylergotaman-3',6',18-trione Preparation Products And Raw materials

Raw materials

Preparation Products

5'alpha(S)-sec-butyl-12'-hydroxy-2'-isopropylergotaman-3',6',18-trione Suppliers

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5'alpha(S)-sec-butyl-12'-hydroxy-2'-isopropylergotaman-3',6',18-trione beta-ergocryptine 12'-Hydroxy-2'-isopropyl-5'α-[(S)-1-methylpropyl]ergotaman-3',6',18-trione (5'α)-12'-Hydroxy-2'-(1-Methylethyl)-5'-[(1S)-1-Methylpropyl]ergotaMan-3',6',18-trione [5'α(S)]-12'-Hydroxy-2'-(1-Methylethyl)-5'-(1-Methylpropyl)ergotaMan-3',6',18-trione b-Ergocryptine Bromocriptine Impurity 1 Ergotaman-3',6',18-trione, 12'-hydroxy-2'-(1-methylethyl)-5'-[(1S)-1-methylpropyl]-, (5'α)- β-Ergocryptine -β-Ergocryptine Bromocriptine Impurity 20 (β-Ergocryptine) Hybutimibe Impurity 27 20315-46-2 Aromatics Heterocycles Inhibitors Intermediates & Fine Chemicals Neurochemicals Pharmaceuticals Aromatics, Heterocycles, Inhibitors, Neurochemicals, Pharmaceuticals, Intermediates & Fine Chemicals