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57432-61-8

57432-61-8 structural image
Product Name: Methylergonovine maleate salt
Formula: C24H29N3O6
Synonyms: 9,10-Didehydro-N-[(S)-1-(hydroxymethyl)propyl]-6-methylergoline-8β-carboxamide maleate salt;Methergine maleate salt;Methylergonovine maleate salt
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CHEMICAL AND PHYSICAL PROPERTIES

Collision Cross Section 183.8 Ų [M+H]+ [CCS Type: TW, Method: calibrated with polyalanine and drug standards]

SAFETY INFORMATION

Signal word Danger
Pictogram(s)

Skull and Crossbones
Acute Toxicity
GHS06

Health Hazard
GHS08
GHS Hazard Statements H361:Reproductive toxicity
Precautionary Statement Codes P201:Obtain special instructions before use.
P280:Wear protective gloves/protective clothing/eye protection/face protection.

COMPUTED DESCRIPTORS

Molecular Weight 455.5 g/mol
Hydrogen Bond Donor Count 5
Hydrogen Bond Acceptor Count 7
Rotatable Bond Count 6
Exact Mass 455.20563565 g/mol
Monoisotopic Mass 455.20563565 g/mol
Topological Polar Surface Area 143 Ų
Heavy Atom Count 33
Formal Charge 0
Complexity 668
Isotope Atom Count 0
Defined Atom Stereocenter Count 3
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 1
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 2
Compound Is Canonicalized Yes

PRODUCT INTRODUCTION

description

Methylergonovine Maleate is an ergoline alkaloid. It has a role as a geroprotector.