Tubadil

(1S,16R)-10,25-dimethoxy-15,15,30-trimethyl-7,23-dioxa-15,30-diazoniaheptacyclo[22.6.2.23,6.18,12.118,22.027,31.016,34]hexatriaconta-3(36),4,6(35),8(34),9,11,18(33),19,21,24,26,31-dodecaene-9,21-diol dichloride

Also Known As: Delacurarine|Tubadil|Amelizol|Tubarine|Curarin-haf|Intocostrine T|Tubocurarine chloride|tubocurarine|Amerizol|D-Tubocurarine chloride|Tubocurarina cloruro|d-Paracurarine chloride|Tubocurarini chloridum|d-Tubocurarine dichloride|Tubaine (TN)|Tubocurarine hydrochloride|Cloruro de tubocurarina|Dextrotubocurarine chloride|Chlorure de tubocurarine|d-Tubocurarine hydrochloride|Tubocurarina cloruro [DCIT]|(+)-Tubocurarine chloride|d-(+)-Tubocurarine chloride|Tubocurarine chloride [INN]|Tubocurarine chloride (anhydrous)|7BCM17J5YA|Tubocurarine chloride (INN)|Tubocurarini chloridum [INN-Latin]|(+) - Tubocurarine chloride|Tubocurarine, dichloride, (+)-|EINECS 200-356-9|Tubocurarine chloride anhydrous|(+)-Tubocurarine chloride hydrochloride|AC1L21N8|Chlorure de tubocurarine [INN-French]|Cloruro de tubocurarina [INN-Spanish]|Tubocurarine, chloride, hydrochloride, (+)-|D08655|d-7',12'-Dihydroxy-6,6'-dimethoxy-2,2',2'-trimethyltubocuraranium chloride|Tubocuraranium, 7',12'-dihydroxy-6,6'-dimethoxy-2,2',2'-trimethyl-, chloride, hydrochloride|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, (13aR-(13aR*,25aS*))-

Molecular Formula	C37H42Cl2N2O6
Molecular Weight	680.242 g/mol
LogP	-0.71
Topological Polar Surface Area	81.82 Ų
Hydrogen Bond Donors	3
Hydrogen Bond Acceptors	6
Rotatable Bonds	2
Exact Mass	680.242
Heavy Atoms	47
Complexity	1778.4

Chemical Identifiers

CAS Number	57-94-3
SMILES	C[NH+]1CCC2=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.[Cl-].[Cl-]