(+)-Tubocurarine chloride pentahydrate

Base Information

• Chemical Name: (+)-Tubocurarine chloride pentahydrate
• CAS No.: 6989-98-6
• Deprecated CAS: 1390-11-0,41354-45-4
• Molecular Formula: C37H41 N2 O6 . Cl H . Cl . 5 H2 O
• Molecular Weight: 785.84
• Hs Code.: 29349990
• European Community (EC) Number: 200-356-9,615-023-7
• UNII: 900961Z8VR
• DSSTox Substance ID: DTXSID20930274
• Wikipedia: Tubocurarine_chloride
• Wikidata: Q27271261
• NCI Thesaurus Code: C47777
• ChEMBL ID: CHEMBL3989821

Synonyms:d-Tubocurare;d-Tubocurarine;Tubocurare;Tubocurarine;Tubocurarine Chloride

Chemical Property of (+)-Tubocurarine chloride pentahydrate

Chemical Property:

• Melting Point: 275-280 °C (dec.)(lit.)
• Refractive Index: 193 ° (C=1, H2O)
• PSA: 126.77000
• Density: 1.2074 (rough estimate)
• LogP: 4.08220
• Storage Temp.: 2-8°C
• Sensitive.: Air Sensitive
• Solubility.: H2O: soluble50 mg/ml, with heating as required, clear to slightl
• Water Solubility.: Soluble in water to 50mg/ml, with warming as needed. Also soluble in ethanol or methanol
• Hydrogen Bond Donor Count: 8
• Hydrogen Bond Acceptor Count: 13
• Rotatable Bond Count: 2
• Exact Mass: 770.2948159
• Heavy Atom Count: 52
• Complexity: 990

Purity/Quality:

98%,99%, ^*data from raw suppliers

(+)-TubocurarineChlorideHydrochloridePentahydrate ^*data from reagent suppliers

Safty Information:

• Pictogram(s): T
• Hazard Codes: T
• Statements: 25
• Safety Statements: 45-36/37/39-22

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

• Canonical SMILES: CN1CCC2=CC(=C3C=C2C1CC4=CC=C(C=C4)OC5=C6C(CC7=CC(=C(C=C7)O)O3)[N+](CCC6=CC(=C5O)OC)(C)C)OC.O.O.O.O.O.Cl.[Cl-]
• Isomeric SMILES: CN1CCC2=CC(=C3C=C2[C@@H]1CC4=CC=C(C=C4)OC5=C6[C@@H](CC7=CC(=C(C=C7)O)O3)[N+](CCC6=CC(=C5O)OC)(C)C)OC.O.O.O.O.O.Cl.[Cl-]
• Description: Tubocurarine chloride is the only naturally occurring neuromuscular blocking agent. It is derived from the bark of the South American plant chondrodendron tomentosum, which has been used for centuries by South American Indians as an arrow poison. I t was the first non-depolarising neuromuscular blocking agent to be used in humans. I t has a marked propensity to produce histamine release and thus hypotension, with possibly a compensatory tachycardia. Historically, tubocurarine, alcuronium and gallamine have been used in clinical practice, but they are no longer available in the UK. A lcuronium chloride is a semisynthetic derivative of toxiferin, an alkaloid of calabash curare. Gallamine triethiodide is a trisquaternary amine. It was first used in France in 1948. The only recent use of gallamine in the UK was as a small pretreatment dose (10 mg) before suxamethonium.
• Uses: Tubocurarine is used mainly in anesthesiology as a myorelaxant, causing prolonged muscle relaxation during an operation. Small doses are successful at causing temporary relaxation of skeletal muscle without any vital change of primary body functions. It is used particularly in endotracheal intubation or orthopedic surgery for repositioning fractures, resetting compound dislocations, and so on. The main synonyms are tubarine and curarine. antibacterial
• Therapeutic Function: Muscle relaxant

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