| SpectraBase Spectrum ID |
Hj33Lq0hVpq |
| Name |
(1r,3r,5r,7r)-6-{[(6aR,9R,10aR)-1,9-bis(methoxymethoxy)-6,6-dimethyl-6H,6aH,7H,8H,9H,10H,10aH-benzo[c]isochromen-3-yl]methyl}-2-oxa-6-azatricyclo[3.3.1.1(3,7)]decane |
| Appearance |
Clear, colorless oil |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C28H41NO6 |
| InChI |
InChI=1S/C28H41NO6/c1-28(2)24-6-5-20(32-15-30-3)13-23(24)27-25(33-16-31-4)7-17(8-26(27)35-28)14-29-18-9-21-11-19(29)12-22(10-18)34-21/h7-8,18-24H,5-6,9-16H2,1-4H3/t18?,19?,20-,21-,22?,23-,24-/m1/s1 |
| InChIKey |
UUTBWTBZNCJHNE-OKLBNXMZSA-N |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1021/jm100390h |
| Molecular Weight |
487.637 g/mol |
| Optical Rotation |
[a]D23 = -60.3o (c = 0.029, MeOH) |
| SMILES |
C1[C@](C[C@@]2([C@@](C1)(C(Oc1c2c(cc(c1)CN1C2CC3CC1CC(O3)C2)OCOC)(C)C)[H])[H])(OCOC)[H] |
| SPLASH |
splash10-066r-6191300000-065d83da6dd77f8cd238 |
| Source of Spectrum |
AF-53-5664-43 |
| Wiley ID |
1846178 |
![(1r,3r,5r,7r)-6-{[(6aR,9R,10aR)-1,9-bis(methoxymethoxy)-6,6-dimethyl-6H,6aH,7H,8H,9H,10H,10aH-benzo[c]isochromen-3-yl]methyl}-2-oxa-6-azatricyclo[3.3.1.1(3,7)]decane](/api/spectrum/Hj33Lq0hVpq/structure.png?h=300&w=458 "(1r,3r,5r,7r)-6-{[(6aR,9R,10aR)-1,9-bis(methoxymethoxy)-6,6-dimethyl-6H,6aH,7H,8H,9H,10H,10aH-benzo[c]isochromen-3-yl]methyl}-2-oxa-6-azatricyclo[3.3.1.1(3,7)]decane")
