Ergonovine maleate

Base Information

• Chemical Name: Ergonovine maleate
• CAS No.: 129-51-1
• Deprecated CAS: 6815-20-9,912-07-2,78207-84-8
• Molecular Formula: C19H23N3O2^.C4H4O4
• Molecular Weight: 441.484
• Hs Code.: 29396100
• European Community (EC) Number: 204-953-5
• UNII: YMH3D0ZJWV
• Wikidata: Q27114403
• NCI Thesaurus Code: C76962
• ChEMBL ID: CHEMBL1213135
• Mol file: 129-51-1.mol

Synonyms:Ergobasin;Ergometrin;Ergometrine;Ergometrine Maleate;Ergonovine;Ergonovine Maleate;Ergotrate

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Chemical Property of Ergonovine maleate

Chemical Property:

• Appearance/Colour: white or faintly yellow, crystalline powder; odourless.
• Vapor Pressure: 3.64E-28mmHg at 25°C
• Melting Point: ca. 200 C
• Refractive Index: 1.6500 (estimate)
• Boiling Point: 635.2 ºCat 760 mmHg
• Flash Point: 337.9 ºC
• PSA: 142.96000
• Density: 1.3g/cm³
• LogP: 1.57520
• Storage Temp.: −20°C
• Hydrogen Bond Donor Count: 5
• Hydrogen Bond Acceptor Count: 7
• Rotatable Bond Count: 5
• Exact Mass: 441.18998559
• Heavy Atom Count: 32
• Complexity: 654

Purity/Quality:

Safty Information:

• Pictogram(s): T
• Hazard Codes: T
• Statements: 23/24/25
• Safety Statements: 36/37-45

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

• Canonical SMILES: CC(CO)NC(=O)C1CN(C2CC3=CNC4=CC=CC(=C34)C2=C1)C.C(=CC(=O)O)C(=O)O
• Isomeric SMILES: C[C@@H](CO)NC(=O)[C@H]1CN([C@@H]2CC3=CNC4=CC=CC(=C34)C2=C1)C.C(=C\C(=O)O)\C(=O)O
• Recent ClinicalTrials: Carbetocin Versus Ergometrin in the Prevention of Postpartum Hemorrhage
• Recent EU Clinical Trials: Intramuscular oxytocics: A multi-centre randomised comparison study of intramuscular Carbetocin, Syntocinon and Syntometrine for the third stage of labour following vaginal birth
• Uses: Ergonovine is an oxytocic, stimulates contraction of uterine muscle; partial agonist at serotonergic and dopaminergic receptors in CNS; selective, potent antagonist at smooth muscle serotonergic receptors.

Technology Process of Ergonovine maleate

There total 1 articles about Ergonovine maleate which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield:

→ Ergometrinum maleicum (129-51-1,4555-75-3,29897-94-7,53110-15-9,120273-19-0)

Guidance literature:

Lysergsaeure (I), 1) COCl2-HCONMe2-Komplex, 2) L-2-Aminopropanol, DMF, 3) Maleinsaeure;

Reference yield: 96.0%

ergonovine maleate (129-51-1) → ergometrine (60-79-7)

Guidance literature:

With sodium hydrogencarbonate; In water; ethyl acetate; at 20 ℃; for 0.5h;

DOI:10.3390/molecules25020331

Downstream raw materials:

ergometrine