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Beta-ergocryptine

CAS
20315-46-2
Catalog Number
ACM20315462
Category
Other Products
Molecular Weight
575.69844;g/mol
Molecular Formula
C32H41N5O5

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Specification

Synonyms
(5α)-5-[(2S)-2-Butanyl]-12-hydroxy-2-isopropyl-3,6,18-triox oergotam; beta-ergocryptine; β-Ergocryptine;
IUPAC Name
β-ergocryptine
Canonical SMILES
CCC(C)C1C(=O)N2CCCC2C3(N1C(=O)C(O3)(C(C)C)NC(=O)C4CN(C5CC6=CNC7=CC=CC(=C67)C5=C4)C)O
InChI Key
YYWXOXLDOMRDHW-SDMXVIBFSA-N
Boiling Point
861.5ºC at 760 mmHg
Flash Point
474.8ºC
Density
1.38g/cm³
EC Number
243-728-6
Exact Mass
575.31100
Packing Group
III
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