Pancuroniumbromid
Poncuronium bromide
Grundinformationen
- CAS
15500-66-0- Standard-SMILES
CC(=O)OC1CC2CCC3C(CCC4(C)C3CC([N+]3(C)CCCCC3)C4OC(C)=O)C2(C)CC1[N+]1(C)CCCCC1.[Br-]- InChIKey
FUSSNJWODJHPKO-UHFFFAOYSA-M- Summenformel
- C35H60BrN2O4+
- Durchschnittliche Molmasse
- 652,8 g/mol
- Monoisotopische Masse
- 651,37365
Namen und Bezeichner
- Bevorzugter Name
- Poncuronium bromide
- IUPAC
- [17-acetyloxy-10,13-dimethyl-2,16-bis(1-methylpiperidin-1-ium-1-yl)-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-3-yl] acetate bromide
- Lokaler Name
- Pancuroniumbromid
- Englischer Name
- Pancuronium bromide
- Summenformel
- C35H60Br2N2O4
- Molmasse
- 732.67
Namen und Synonyme
Poncuronium bromideHMS3370B13HMS3393E071,1'-[(2beta,3alpha,5alpha,16beta,17beta)-3,17-bis(Acetyloxy)androstane-2,16-diyl]bis(1-methylpiperidinium) dibromide2.beta.,17.beta.-diol diacetate dimethobromide3.alpha.,16.beta.-dipiperidino-5.alpha.-androstane dimethobromide5.alpha.-Androstan-3.alpha., 2.beta.,16.beta.-dipipecolinio-, dibromide, diacetateWLN: L E5 B666TJ A1 E1 FOV1 OOV1 G- AT6KTJ A1& P- AT6KTJ A1 &E 2(2)1,17.beta.-Dihydroxy-5.alpha.-androstan-2.beta.,16.beta.-ylene)bis[1-methylpiperidinium] dibromide diacetatePiperidinium,1'-(3.alpha.,17.beta.-dihydroxy-5.alpha.-androstan-2.beta.,16.beta.-ylene)bis[1-methyl-, dibromide, diacetatePiperidinium,1'-[(2.beta.,3.alpha.,5.alpha.,16.beta.,17.beta.)-3,17-bis(acetyloxy)androstane-2,16-diyl]bis[1-methyl-, dibromidePiperidinium,1'-[(2.beta.,3.alpha.,5.alpha.,16.beta.,17.beta.)-3,17-bis(acetyloxy)androstane-2,16-diyl]bis[1-methyl]-, dibromide
Weitere Namen anzeigen
diacetatepancuroniumpavulonacetic acid [17-acetyloxy-10,13-dimethyl-2,16-bis(1-methyl-1-piperidin-1-iumyl)-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-3-yl] ester dibromide
Eigenschaften
Berechnete Struktureigenschaften
- Polarare Oberfläche (TPSA)
- 52,6 Ų
- H-Brücken-Donoren
- 0
- H-Brücken-Akzeptoren
- 5
- Frei drehbare Bindungen
- 6
- Schwere Atome
- 42
- Formalladung
- 1
- Komplexität
- 1.000
Physikochemische Eigenschaften
- Schmelzpunkt
- 215 ° · 215°
- Siedepunkt
- 100 °C · ~100°C
- Dichte
- 1 · ~1, mp: 0°C
- storage temp.
- 2 · 2-8°C
- Löslichkeit
- Very soluble or freely soluble in water, very soluble in methylene chloride, freely soluble in ethanol (96 per cent).
- Aggregatzustand
- Off-white solid
- Farbe
- Clear, colorless solution
- Geruch (Odor)
- Odorless
- Wasserlöslichkeit
- 100 mM · water: 100mM
- Merck
- 13 · 13,7077
- BRN
- 4226892 · 4226892
- Major Application
- pharmaceutical (small molecule)
- InChIKey
- NPIJXCQZLFKBMV-LQDGISGANA-L
- SMILES
- [Br-].[Br-].[H][C@@]12CC[C@]3([H])[C@]([H])(CC[C@]4(C)[C@@H](OC(C)=O)[C@H](C[C@@]34[H])[N+]5(C)CCCCC5)[C@@]1(C)C[C@@H]([C@H](C2)OC(C)=O)[N+]6(C)CCCCC6
- CAS Datenbank
- 15500 · 15500-66-0(CAS DataBase Reference)
Sicherheit und Regulatorisches
Sicherheitsangaben dienen nur zur Orientierung und ersetzen weder das Sicherheitsdatenblatt (SDB) des Lieferanten noch geltende Vorschriften oder eine fachliche Bewertung.
Sicherheitsdaten
- F
- 10-21-33
- wgk
- 3
- ridadr
- UN 2811 6.1/PG 3
- hs_code
- 2933399090
- RTECS-Nr.
- TN4930000
- risk_code
- 22
- Toxizität
- LD50 in mice (mg/kg): 0.047 i.v.; 0.152 i.p.; 0.167 s.c.; 21.9 orally; in rats, rabbits: 0.153, 0.016 i.v. (Buckett, 1968)
- hazard_code
- Xn
- hazard_class
- 6.1(b)
- packing_group
- III
- Speicherklasse
- 6.1C - Combustible acute toxic Cat.3toxic compounds or compounds which causing chronic effects
- Giftige Stoffe Daten
- 15500-66-0(Hazardous Substances Data)
- Hazard Classifications
- Acute Tox. 3 Oral
Chemie und Industrie
Anwendungen
BeschreibungPancuronium bromide, a bisquaternary amine and the first steroid N MBA used clinically, was developed by Savege and Hewitt and marketed in 1964. The intubating dose is 0.1mgkg–1, which takes 3-4min to reach its maximum effect. The clinical duration of action of the drug is long, especially in the presence of potent inhalational agents or renal dysfunction, as 60% of a dose of the drug is excreted unchanged through the kidneys. I t is also deacetylated in the liver; some of the metabolites have neuromuscular blocking properties.Pancuronium does not stimulate histamine release; however, it has direct vagolytic and sympathomimetic effects which may cause tachycardia and hypertension. It slightly inhibits plasma cholinesterase and therefore potentiates any drug metabolised by this enzyme, such as suxamethonium and mivacurium.
VerwendenPancuronium Bromide has been used as an analgesic in various experiments.
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