CAS 6989-98-6

13H-4,6:21,24-Dietheno-8,12-metheno-1H-pyrido[3′,2′:14,15][1,11]dioxacycloeicosino[2,3,4-ij]isoquinolinium, 2,3,13a,14,15,16,25,25a-octahydro-9,19-dihydroxy-18,29-dimethoxy-1,14,14-trimethyl-, chloride, hydrochloride, hydrate (1:1:1:5), (13aR,25aS)-

Description:

The chemical substance known as 13H-4,6:21,24-Dietheno-8,12-metheno-1H-pyrido[3′,2′:14,15][1,11]dioxacycloeicosino[2,3,4-ij]isoquinolinium, with the CAS number 6989-98-6, is a complex organic compound characterized by its intricate polycyclic structure, which includes multiple fused rings and functional groups. This substance features a pyridoisoquinoline framework, indicative of its potential biological activity. The presence of methoxy and hydroxy groups suggests it may exhibit solubility in polar solvents and could participate in hydrogen bonding. The compound is typically encountered in a hydrated form, which may influence its stability and reactivity. As a chloride salt, it may exhibit ionic characteristics, affecting its interaction with biological systems. Its stereochemistry, denoted by the (13aR,25aS) configuration, implies specific spatial arrangements that could be crucial for its pharmacological properties. Overall, this compound's unique structural features and functional groups may contribute to its potential applications in medicinal chemistry and pharmacology, although specific biological activities would require further investigation.

Formula: C₃₇H₄₁N₂O₆·ClH·Cl·5H₂O

InChI: InChI=1S/C37H40N2O6.2ClH.5H2O/c1-38-14-12-24-19-32(42-4)33-21-27(24)28(38)16-22-6-9-26(10-7-22)44-37-35-25(20-34(43-5)36(37)41)13-15-39(2,3)29(35)17-23-8-11-30(40)31(18-23)45-33;;;;;;;/h6-11,18-21,28-29H,12-17H2,1-5H3,(H-,40,41);2*1H;5*1H2/t28-,29+;;;;;;;/m0......./s1

InChI key: InChIKey=WMIZITXEJNQAQK-GGDSLZADSA-N

SMILES: OC1=C2C=3[C@@](CC=4C=C(OC=5C=C6[C@](CC=7C=CC(O2)=CC7)(N(C)CCC6=CC5OC)[H])C(O)=CC4)([N+](C)(C)CCC3C=C1OC)[H].[Cl-].Cl.O

Synonyms:

• (+)-Tubocurarine Dichloride Pentahydrate
• (+)-Tubocurarine chloride hydrochloride pentahydrate
• 13H-4,6:21,24-Dietheno-8,12-metheno-1H-pyrido[3',2':14,15][1,11]dioxacycloeicosino[2,3,4-ij]isoquinolinium, 2,3,13a,14,15,16,25,25a-octahydro-9,19-dihydroxy-18,29-dimethoxy-1,14,14-trimethyl-, chloride, hydrochloride, pentahydrate, (13aR,25aS)-
• 13H-4,6:21,24-Dietheno-8,12-metheno-1H-pyrido[3′,2′:14,15][1,11]dioxacycloeicosino[2,3,4-ij]isoquinolinium, 2,3,13a,14,15,16,25,25a-octahydro-9,19-dihydroxy-18,29-dimethoxy-1,14,14-trimethyl-, chloride, hydrochloride, hydrate (1:1:1:5), (13aR,25aS)-
• 13H-4,6:21,24-Dietheno-8,12-metheno-1H-pyrido[3′,2′:14,15][1,11]dioxacycloeicosino[2,3,4-ij]isoquinolinium, 2,3,13a,14,15,16,25,25a-octahydro-9,19-dihydroxy-18,29-dimethoxy-1,14,14-trimethyl-, chloride, hydrochloride, pentahydrate, (13aR,25aS)-
• 7',12'-Dihydroxy-6,6'-dimethoxy-2,2',2'-trimethyltubocuraranium Chloride Hydrochloride Pentahydrate
• Tubarine pentahydrate
• Tubocuraranium, 7',12'-dihydroxy-6,6'-dimethoxy-2,2',2'-trimethyl-, chloride, hydrochloride, pentahydrate
• Tubocuraranium, 7′,12′-dihydroxy-6,6′-dimethoxy-2,2′,2′-trimethyl-, chloride, hydrochloride, pentahydrate
• Tubocurarine Chloride (anhydrous)
• d-Tubocurarine dichloride pentahydrate

Tubocurarine Chloride

CAS: 6989-98-6

Other alkaloids,natural or reproduced by synthesis, and their salts, ethers,esters&other derivatives, nesoi

Formula: C₃₇H₄₁ClN₂O₆·HCl·5H₂O

Color and Shape: Powder

Molecular weight: 644.26531

Ref: 45-1702008

(+)-Tubocurarine chloride pentahydrate

CAS: 6989-98-6

Formula: C₃₇H₅₂Cl₂N₂O₁₁

Purity: 98%

Color and Shape: Solid

Molecular weight: 771.7216

Ref: IN-DA00FCSZ

Tubocurarine hydrochloride pentahydrate

CAS: 6989-98-6

Formula: C₃₇H₄₁ClN₂O₆·HCl·5H₂O

Purity: ≥ 97.0%

Color and Shape: White to beige powder

Molecular weight: 771.72

Ref: 7W-GL8928

(+)-Tubocurarine Chloride Hydrochloride Pentahydrate

Controlled Product

CAS: 6989-98-6

Stability Hygroscopic
Applications (+)-Tubocurarine Chloride, is a a long-duration antagonist for nicotinic acetylcholine receptor, used widely in anesthesia to provide skeletal muscle relaxation during surgery or mechanical ventilation.
Not a dangerous good if item is equal to or less than 1g/ml and there is less than 100g/ml in the package
References Bren, N., et al.: J. Biol. Chem., 272, 30793 (1997); Fu, D.X., et al.: J. Biol. Chem., 269 (1994); Gronert, G.A.,et al.L J, App. Physiol. Resprat. Envrion. Exercise. Physiol., 57, 1502 (1984); Hughes, R., et al.: Brit. J. Anaesthesia., 48, 847 (1976);

Formula: C₃₇H₄₁N₂O₆·Cl·ClH·5H₂O

Color and Shape: Neat

Molecular weight: 771.72

Ref: TR-T947620