(+)-O,O-Dimethyltubocurine
9,10,21,25-tetramethoxy-15,30-dimethyl-7,23-dioxa-15,30-diazaheptacyclo[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
Also Known As: (+)-O,O-Dimethyltubocurine|hyatinin methochloride|Chondrocurine, O,O-dimethyl-|Tubocuraran, 6,6',7',12'-tetramethoxy-2,2'-dimethyl-|Tubocuraran, 6,6',7':12'-tetramethoxy-2,2'-dimethyl-|Tubocurarine, 2,2'-didemethyl-O,O'-dimethyl-|6,6',7',12'-Tetramethoxy-2,2'-dimethyltubocuraran|6,6',7',12'-Tetramethoxy-2,2'-dimethyltubocuraran #|Opt.-inakt. 6,6',7',12'-Tetramethoxy-2,2'-dimethyl-tubocuraran
| Molecular Formula | C38H42N2O6 |
|---|---|
| Molecular Weight | 622.30426 g/mol |
| LogP | 6.7 |
| Topological Polar Surface Area | 61.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 4 |
| Exact Mass | 622.30426 |
| Monoisotopic Mass | 622.30426 |
| Heavy Atoms | 46 |
| Complexity | 979.0 |
Chemical Identifiers
| CAS Number | 2233-44-5 |
|---|---|
| SMILES | CN1CCC2=CC(=C3C=C2C1CC4=CC=C(C=C4)OC5=C6C(CC7=CC(=C(C=C7)OC)O3)N(CCC6=CC(=C5OC)OC)C)OC |
| InChIKey | BWFWPNFEEDTSFC-UHFFFAOYSA-N |
Product Overview
(+)-O,O-Dimethyltubocurine (CAS 2233-44-5), with molecular formula C38H42N2O6 and molecular weight 622.30426 g/mol. IUPAC: 9,10,21,25-tetramethoxy-15,30-dimethyl-7,23-dioxa-15,30-diazaheptacyclo[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.
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