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Mergocriptine

Mergocriptine structure

CAS No:
81968-16-3
Formula:
C33H43N5O5
Chemical Name:
Mergocriptine
Synonyms:
CBM-36-733;Mergocryptine;Mergocriptine;2-Methylergocryptine;2-Methylergocriptine;2-Methyl-α-ergocriptine;12'-Hydroxy-2-methyl-2'-(1-methylethyl)-5'α-(2-methylpropyl)ergotaman-3',6',18-trione

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Mergocriptine Basic Attributes

Molecular Weight：

589.737

Exact Mass：

589.32600

UNII：

VXD47YRH4Q

Characteristics

PSA：

118

XLogP3：

3.39270

Density：

1.36g/cm3

Boiling Point：

865.7ºC at 760 mmHg

Flash Point：

477.3ºC

Refractive Index：

1.673

Drug Information

MeSH Entry Terms：

2-CBM

Computed Properties

Molecular Weight:589.7
XLogP3:3.1
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:5
Exact Mass:589.32641949
Monoisotopic Mass:589.32641949
Topological Polar Surface Area:118
Heavy Atom Count:43
Complexity:1220
Defined Atom Stereocenter Count:6
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of Mergocriptine

Basic Attributes
Characteristics
Drug Information
Computed Properties

Mergocriptine

SDS

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