| SpectraBase Spectrum ID |
DS7dnfVqdPH |
| Name |
6-[(6aR,9R,10aR)-1,9-bis(methoxymethoxy)-6,6-dimethyl-6H,6aH,7H,8H,9H,10H,10aH-benzo[c]isochromene-3-carbonyl]-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 |
C28H39NO7 |
| InChI |
InChI=1S/C28H39NO7/c1-28(2)23-6-5-19(33-14-31-3)13-22(23)26-24(34-15-32-4)7-16(8-25(26)36-28)27(30)29-17-9-20-11-18(29)12-21(10-17)35-20/h7-8,17-23H,5-6,9-15H2,1-4H3/t17?,18?,19-,20-,21?,22-,23-/m1/s1 |
| InChIKey |
ZWGSNGBRACQGFA-RLQBJJHXSA-N |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1021/jm100390h |
| Molecular Weight |
501.620 g/mol |
| Optical Rotation |
[a]D23 = -33.3o (c = 0.011, CH2Cl2) |
| SMILES |
C1[C@](C[C@@]2([C@@](C1)(C(Oc1c2c(cc(c1)C(=O)N1C2CC3CC1CC(O3)C2)OCOC)(C)C)[H])[H])(OCOC)[H] |
| SPLASH |
splash10-0002-5429110000-539c062ca800fbdc4cbb |
| Source of Spectrum |
AF-53-5663-35 |
| Wiley ID |
1846176 |
![6-[(6aR,9R,10aR)-1,9-bis(methoxymethoxy)-6,6-dimethyl-6H,6aH,7H,8H,9H,10H,10aH-benzo[c]isochromene-3-carbonyl]-2-oxa-6-azatricyclo[3.3.1.1(3,7)]decane](/api/spectrum/DS7dnfVqdPH/structure.png?h=300&w=458 "6-[(6aR,9R,10aR)-1,9-bis(methoxymethoxy)-6,6-dimethyl-6H,6aH,7H,8H,9H,10H,10aH-benzo[c]isochromene-3-carbonyl]-2-oxa-6-azatricyclo[3.3.1.1(3,7)]decane")
