Dimethylcycleanine

(11R,26R)-4,5,19,20-tetramethoxy-10,10,25,25-tetramethyl-2,17-dioxa-10,25-diazoniaheptacyclo[26.2.2.213,16.13,7.118,22.011,36.026,33]hexatriaconta-1(31),3(36),4,6,13,15,18(33),19,21,28(32),29,34-dodecaene dibromide

CAS: 75846-14-9

Molecular Formula	`C40H48Br2N2O6`
Molecular Weight	812.6 g/mol
Topological Polar Surface Area	55.4 A2
Hydrogen Bond Donors	0
Hydrogen Bond Acceptors	8
Rotatable Bonds	4
Exact Mass	812.18585
Heavy Atoms	50
Complexity	974.0

Chemical Identifiers

CAS Number	75846-14-9
SMILES	`C[N+]1(CCC2=CC(=C(C3=C2C1CC4=CC=C(C=C4)OC5=C6C(CC7=CC=C(O3)C=C7)[N+](CCC6=CC(=C5OC)OC)(C)C)OC)OC)C.[Br-].[Br-]`
InChIKey	`PLXGCAIEWRLPEO-YIECZYFASA-L`

📖 Product Overview

Dimethylcycleanine (CAS: 75846-14-9) is a chemical compound with molecular formula C40H48Br2N2O6 and molecular weight 812.6 g/mol. Its IUPAC systematic name is (11R,26R)-4,5,19,20-tetramethoxy-10,10,25,25-tetramethyl-2,17-dioxa-10,25-diazoniaheptacyclo[26.2.2.213,16.13,7.118,22.011,36.026,33]hexatriaconta-1(31),3(36),4,6,13,15,18(33),19,21,28(32),29,34-dodecaene dibromide. Topological Polar Surface Area 55.4 A2 Hydrogen Bond Donors 0 Hydrogen Bond Acceptors 8 Rotatable Bonds 4 Exact Mass 812.18585 Heavy Atoms 50 Complexity 974.0 InChI Key: PLXGCAIEWRLPEO-YIECZYFASA-L. SMILES: C[N+]1(CCC2=CC(=C(C3=C2C1CC4=CC=C(C=C4)OC5=C6C(CC7=CC=C(O3)C=C7)[N+](CCC6=CC(=C5OC)OC)(C)C)OC)OC)C.[Br-].[Br-].

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