Thalrugosine, (+)-
(1S,14R)-9,20,25-trimethoxy-15,30-dimethyl-7,23-dioxa-15,30-diazaheptacyclo[22.6.2.23,6.18,12.114,18.027,31.022,33]hexatriaconta-3(36),4,6(35),8,10,12(34),18,20,22(33),24,26,31-dodecaen-21-ol
Also Known As: Fangchinoline|Isofangchinoline|Thaligine|(R)-Fangchinoline|Demethyl tetrandrine|THALRUGOSINE|Limacine|(+)-Thalrugosine|Allyl carbamate|Hanfangchin B|( )-Thalrugosine|Limacine (R,R)|7-O-Demethyltetrandrine|Thalrugosine;Thaligine|D-ISOFANGCHINOLINE|THALRUGOSINE, (+)-|HY-N1372|s3606|AC-8013|D-Isofangchinoline; Demethyl Tetrandrine|6,6',12-trimethoxy-2,2'-dimethylberbaman-7-ol|(11S,31R)-16,36,54-trimethoxy-12,32-dimethyl-11,12,13,14,31,32,33,34-octahydro-2,6-dioxa-1(7,1),3(8,1)-diisoquinolina-5(1,3),7(1,4)-dibenzenacyclooctaphan-37-ol|(S)-4-isopropyl-1,3-thiazolidine-2-thione
| Molecular Formula | C37H40N2O6 |
|---|---|
| Molecular Weight | 608.28864 g/mol |
| LogP | 6.86 |
| Topological Polar Surface Area | 72.86 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 3 |
| Exact Mass | 608.28864 |
| Heavy Atoms | 45 |
| Complexity | 1736.6 |
Chemical Identifiers
| CAS Number | 33889-68-8 |
|---|---|
| SMILES | CN1CCC2=CC(=C3C=C2[C@@H]1CC4=CC=C(C=C4)OC5=C(C=CC(=C5)C[C@@H]6C7=C(O3)C(=C(C=C7CCN6C)OC)O)OC)OC |
Product Overview
Thalrugosine, (+)- (CAS 33889-68-8), with molecular formula C37H40N2O6 and molecular weight 608.28864 g/mol. IUPAC: (1S,14R)-9,20,25-trimethoxy-15,30-dimethyl-7,23-dioxa-15,30-diazaheptacyclo[22.6.2.23,6.18,12.114,18.027,31.022,33]hexatriaconta-3(36),4,6(35),8,10,12(34),18,20,22(33),24,26,31-dodecaen-21-ol.
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