| SpectraBase Compound ID | 2a2Jr5LNzOz |
|---|---|
| InChI | InChI=1S/C38H42N2O6/c1-39-15-13-25-20-32(42-4)34-22-28(25)29(39)17-23-7-10-27(11-8-23)45-33-19-24(9-12-31(33)41-3)18-30-36-26(14-16-40(30)2)21-35(43-5)37(44-6)38(36)46-34/h7-12,19-22,29-30H,13-18H2,1-6H3 |
| InChIKey | WVTKBKWTSCPRNU-UHFFFAOYSA-N |
| Mol Weight | 622.8 g/mol |
| Molecular Formula | C38H42N2O6 |
| Exact Mass | 622.304287 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | CvsNZbQknic |
|---|---|
| Name | O,O-Dimethylkrukovine |
| Alternate Name(s) | (+)-Tetrandrine (-)-Phaeanthine (1.beta.)-6,6',7,12-Tetramethoxy-2,2'-dimethylberbaman 16H-1,24:6,9-dietheno-11,15-metheno-2H-pyrido(2',3':17,18)(1,11)dioxacycloeicosino(2,3,4-ij)isoquinoline, 3,4,4a,5,16a,17,18,190octahydro-12,21,22,26-tetramethoxy-4,17-dimethyl-, (4aR,16aR)- 6,6',7,12-tetramethoxy-2,2'-dimethyl-9',10',11',12',13',14'-hexadehydro-9',10',11',12',13',14'-hexahydroberbaman 6,6',7,12-Tetramethoxy-2,2'-dimethylberbaman Berbaman, 6,6',7,12-tetramethoxy-2,2'-dimethyl-, (1'-beta)- Berbaman, 6,6',7,12-tetramethoxy-2,2'-dimethyl-, (1.beta.)- d-Tetrandrine Pheanthine R,R-tetrandrine Tetrandrin Tetrandrine NSC 105130 NSC 77037 |
| CAS Registry Number | 1263-79-2 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C38H42N2O6 |
| InChI | InChI=1S/C38H42N2O6/c1-39-15-13-25-20-32(42-4)34-22-28(25)29(39)17-23-7-10-27(11-8-23)45-33-19-24(9-12-31(33)41-3)18-30-36-26(14-16-40(30)2)21-35(43-5)37(44-6)38(36)46-34/h7-12,19-22,29-30H,13-18H2,1-6H3 |
| InChIKey | WVTKBKWTSCPRNU-UHFFFAOYSA-N |
| Molecular Weight | 622.762 g/mol |
| SMILES | COc1c2c3C(Cc4cc(c(OC)cc4)Oc4ccc(cc4)CC4c5cc(c(OC)cc5CCN4C)O2)N(C)CCc3cc1OC |
| SPLASH | splash10-00di-0302009000-2a834f0350b02143b4e1 |
| Source of Spectrum | J-41-318-0 |
| Wiley ID | 1411687 |