| SpectraBase Spectrum ID |
53XAToNfmoa |
| Name |
O,O-Diethylthalirugine |
| CAS Registry Number |
64215-91-4 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C42H52N2O7 |
| InChI |
InChI=1S/C42H52N2O7/c1-9-49-38-25-32-29(24-37(38)46-6)17-19-43(3)34(32)22-28-13-16-36(45-5)39(23-28)51-30-14-11-27(12-15-30)21-35-33-26-40(47-7)42(48-8)41(50-10-2)31(33)18-20-44(35)4/h11-16,23-26,34-35H,9-10,17-22H2,1-8H3 |
| InChIKey |
DHPPIXRPMIFBEL-UHFFFAOYSA-N |
| Molecular Weight |
696.885 g/mol |
| SMILES |
c12c(c(OCC)c(c(c2)OC)OC)CCN(C1Cc1ccc(Oc2c(ccc(CC3c4c(cc(c(c4)OCC)OC)CCN3C)c2)OC)cc1)C |
| SPLASH |
splash10-006x-0890000000-07c511115f78b94542b0 |
| Source of Spectrum |
J-43-585-0 |
| Synonyms |
5-Ethoxy-1-(4-{5-[(7-ethoxy-6-methoxy-2-methyl-1,2,3,4-tetrahydro-1-isoquinolinyl)methyl]-2-methoxyphenoxy}benzyl)-6,7-dimethoxy-2-methyl-1,2,3,4-tetrahydroisoquinoline |
| Wiley ID |
1414947 |
