| SpectraBase Spectrum ID |
ESP3e3uscNP |
| Name |
(1S*,3S*,4R*,5S*,6R*,8R*,9S*,11S*,13R*)-3,4,5,7-Tetrachloro-11-isopropyl-1,6,6-trimethoxy-8-methyl-2,12-dioxapentacyclo[6.5.0.0(3,7).0(5,9).0(11,13)]dodecan-10-one |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C18H22Cl4O6 |
| InChI |
InChI=1S/C18H22Cl4O6/c1-7(2)13-9(23)8-12(3)16(24-4,11(13)27-13)28-15(21)10(19)14(8,20)18(25-5,26-6)17(12,15)22/h7-8,10-11H,1-6H3/t8-,10-,11?,12-,13?,14-,15-,16-,17+/m1/s1 |
| InChIKey |
SDXJKSBMPVTDJZ-UOTGLUJQSA-N |
| Molecular Weight |
476.180 g/mol |
| SMILES |
[C@@]12([C@]3([C@](Cl)([C@](C2(OC)OC)(Cl)[C@]2([C@@]1([C@](C1OC1(C2=O)C(C)C)(OC)O3)C)[H])[H])Cl)Cl |
| SPLASH |
splash10-0udi-0900100000-6e728b3438a74cfe2c3b |
| Source of Spectrum |
AH-125-1000-14 |
| Synonyms |
(4R,5R,6S,8S)-2,4,5,6-tetrachloro-11-isopropyl-3,3,8-trimethoxy-1-methyl-7,10-dioxapentacyclo[6.5.0.0(2,6).0(4,13).0(9,11)]tridecan-12-one |
| Wiley ID |
1393736 |
![(1S*,3S*,4R*,5S*,6R*,8R*,9S*,11S*,13R*)-3,4,5,7-Tetrachloro-11-isopropyl-1,6,6-trimethoxy-8-methyl-2,12-dioxapentacyclo[6.5.0.0(3,7).0(5,9).0(11,13)]dodecan-10-one](/api/spectrum/ESP3e3uscNP/structure.png?h=300&w=458 "(1S*,3S*,4R*,5S*,6R*,8R*,9S*,11S*,13R*)-3,4,5,7-Tetrachloro-11-isopropyl-1,6,6-trimethoxy-8-methyl-2,12-dioxapentacyclo[6.5.0.0(3,7).0(5,9).0(11,13)]dodecan-10-one")
