ERGOCORNINE

ERGOCORNINE Structure
CAS No.
564-36-3
Chemical Name:
ERGOCORNINE
Synonyms
NSC 407316;ergocornin;ERGOCORNINE;Ergot Cornyn;ERGOCORNINE USP/EP/BP;ERGOCORNINE >95% DOPAMINE RECEPTOR AGO;12'-Hydroxy-2',5'α-diisopropylergotaman-3',6',18-trione;12′-Hydroxy-2′,5′-α-bis(1-methyl-ethyl)ergotaman-3′,6′,18-trion;12′-Hydroxy-2′,5′-α-bis(1-methyl-ethyl)ergotaman-3′,6′,18-trione;(5'α)-12'-Hydroxy-2',5'-bis(1-Methylethyl)ergotaMan-3',6',18-trione
CBNumber:
CB0683089
Molecular Formula:
C31H39N5O5
Molecular Weight:
561.67
MOL File:
564-36-3.mol
MSDS File:
SDS
Modify Date:
2023/4/23 13:52:06

ERGOCORNINE Properties

Melting point 182-184℃ (decomposition) (methanol )
alpha D20 -110° (pyridine); -175° (chloroform)
Boiling point 628.48°C (rough estimate)
Density 1.1897 (rough estimate)
refractive index 1.7500 (estimate)
solubility 45% (w/v) aq 2-hydroxypropyl-β-cyclodextrin: 0.4 mg/mL
form solid
pka 9.58±0.60(Predicted)
color white
CAS DataBase Reference 564-36-3

SAFETY

Risk and Safety Statements

RIDADR  UN 1544 6.1/PG 3
WGK Germany  3
RTECS  KE7630000
HazardClass  6.1(b)
PackingGroup  III

ERGOCORNINE Chemical Properties,Uses,Production

Definition

ChEBI: Ergotaman bearing a hydroxy group at the 12' position, isopropyl groups at the 2' and 5'alpha positions, and oxo groups at positions 3', 6', and 18. It is a natural ergot alkaloid.

Purification Methods

It crystallises with solvent of crystallisation from MeOH. [Stadler et al. Helv Chim Acta 52 1549 1969, Beilstein 25 III/IV 963, 27 II 860.]

ERGOCORNINE Preparation Products And Raw materials

Raw materials

Preparation Products

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ERGOCORNINE ERGOCORNINE >95% DOPAMINE RECEPTOR AGO 12'-HYDROXY-2',5'-ALPHA-BIS(1-METHYL-ETHYL)ERGOTAMAN-3',6',18-TRIONE 18-trione,12’-hydroxy-2’,5’-bis(1-methylethyl)-6(5’-alpha)-ergotaman-3 ergocornin 12′-Hydroxy-2′,5′-α-bis(1-methyl-ethyl)ergotaman-3′,6′,18-trione (5'α)-12'-Hydroxy-2',5'-bis(1-Methylethyl)ergotaMan-3',6',18-trione NSC 407316 12'-Hydroxy-2',5'α-diisopropylergotaman-3',6',18-trione (5'alpha)-12'-Hydroxy-2',5'-bis(1-methylethyl)ergotaman-3',6',18-trione Ergot Cornyn 12′-Hydroxy-2′,5′-α-bis(1-methyl-ethyl)ergotaman-3′,6′,18-trion Ergotaman-3',6',18-trione, 12'-hydroxy-2',5'-bis(1-methylethyl)-, (5'α)- ERGOCORNINE USP/EP/BP 564-36-3 C31H39N5O5 Aromatics Heterocycles Inhibitors Intermediates & Fine Chemicals Neurochemicals Pharmaceuticals