Doxacurium chloride

Doxacurium chloride
Clinical data
Routes of; administration	IV only
ATC code	M03AC07 (WHO) ;
Legal status
Legal status	In general: ℞ (Prescription only);
Pharmacokinetic data
Bioavailability	100% (IV)
Identifiers
	IUPAC name bis[3-[6,7,8-trimethoxy-2-methyl-1- [(3,4,5-trimethoxyphenyl)methyl]- 3,4-dihydro-1H- isoquinolin-2-yl] propyl] butanedioate dichloride;
CAS Number	83348-52-1 ;
PubChem CID	5284551;
DrugBank	DB01135 ;
ChemSpider	4447606 ;
UNII	M78TVM3G5Z;
KEGG	D00760 ;
ChEBI	CHEBI:59819 ;
ChEMBL	ChEMBL1200753 ;
CompTox Dashboard (EPA)	DTXSID7022962 ;
Chemical and physical data
Formula	C56H78Cl2N2O16
Molar mass	1106.14 g·mol−1
3D model (JSmol)	Interactive image;
	SMILES [Cl-].[Cl-].O=C(OCCC[N@+]2(C)[C@H](c1c(OC)c(OC)c(OC)cc1CC2)Cc3cc(OC)c(OC)c(OC)c3)CCC(=O)OCCC[N@+]5([C@@H](c4c(cc(OC)c(OC)c4OC)CC5)Cc6cc(OC)c(OC)c(OC)c6)C;
	InChI InChI=1S/C56H78N2O16.2ClH/c1-57(23-19-37-33-45(65-7)53(69-11)55(71-13)49(37)39(57)27-35-29-41(61-3)51(67-9)42(30-35)62-4)21-15-25-73-47(59)17-18-48(60)74-26-16-22-58(2)24-20-38-34-46(66-8)54(70-12)56(72-14)50(38)40(58)28-36-31-43(63-5)52(68-10)44(32-36)64-6;;/h29-34,39-40H,15-28H2,1-14H3;2*1H/q+2;;/p-2/t39-,40+,57-,58+;; ; Key:APADFLLAXHIMFU-LGIHQUBZSA-L ;
	(what is this?) (verify)

Doxacurium chloride (formerly recognized as BW938U80 or BW A938U) is a neuromuscular-blocking drug or skeletal muscle relaxant in the category of non-depolarizing neuromuscular-blocking drugs, used adjunctively in anesthesia to provide skeletal muscle relaxation during surgery or mechanical ventilation. Unlike a number of other related skeletal muscle relaxants, it is rarely used adjunctively to facilitate endotracheal intubation.

Clinical data

Routes of administration	IV only
ATC code	M03AC07 (WHO)
Legal status
Legal status	In general: ℞ (Prescription only)
Pharmacokinetic data
Bioavailability	100% (IV)
Identifiers
IUPAC name bis[3-[6,7,8-trimethoxy-2-methyl-1- [(3,4,5-trimethoxyphenyl)methyl]- 3,4-dihydro-1H- isoquinolin-2-yl] propyl] butanedioate dichloride
CAS Number	83348-52-1^N
PubChem CID	5284551
DrugBank	DB01135^Y
ChemSpider	4447606^Y
UNII	M78TVM3G5Z
KEGG	D00760^Y
ChEBI	CHEBI:59819^Y
ChEMBL	ChEMBL1200753^N
CompTox Dashboard (EPA)	DTXSID7022962
Chemical and physical data
Formula	C₅₆H₇₈Cl₂N₂O₁₆
Molar mass	1106.14 g·mol⁻¹
3D model (JSmol)	Interactive image
SMILES [Cl-].[Cl-].O=C(OCCC[N@+]2(C)[C@H](c1c(OC)c(OC)c(OC)cc1CC2)Cc3cc(OC)c(OC)c(OC)c3)CCC(=O)OCCC[N@+]5([C@@H](c4c(cc(OC)c(OC)c4OC)CC5)Cc6cc(OC)c(OC)c(OC)c6)C
InChI InChI=1S/C56H78N2O16.2ClH/c1-57(23-19-37-33-45(65-7)53(69-11)55(71-13)49(37)39(57)27-35-29-41(61-3)51(67-9)42(30-35)62-4)21-15-25-73-47(59)17-18-48(60)74-26-16-22-58(2)24-20-38-34-46(66-8)54(70-12)56(72-14)50(38)40(58)28-36-31-43(63-5)52(68-10)44(32-36)64-6;;/h29-34,39-40H,15-28H2,1-14H3;2*1H/q+2;;/p-2/t39-,40+,57-,58+;;^Y Key:APADFLLAXHIMFU-LGIHQUBZSA-L^Y
^NY (what is this?) (verify)