| SpectraBase Spectrum ID |
A9gtShR7rwv |
| Name |
4a(S),4b(S),5(R),8a(R),9(R),10a(S)11a(R)-9-Dimethylmethoxymethyl-2-iodo-7,7,4,4-tetramethyl-1,4,4a,4b,5,8a,9,10a,11a-nonahydro-6,8,10,11-tetraoxacyclopenta[a]fluorene |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C21H33IO6 |
| InChI |
InChI=1S/C21H33IO6/c1-19(2)9-11(22)8-12-15(19)14-17-16(27-21(5,6)28-17)13(26-18(14)25-12)10-24-20(3,4)23-7/h9,12-18H,8,10H2,1-7H3/t12-,13-,14-,15-,16-,17-,18+/m1/s1 |
| InChIKey |
JPLKFVCMPUCYLP-TVLLWILJSA-N |
| Molecular Weight |
508.393 g/mol |
| SMILES |
[C@@]12([C@@](O[C@]3([C@]2(C(C=C(C3)I)(C)C)[H])[H])(O[C@@]([C@@]2([C@@]1(OC(C)(C)O2)[H])[H])(COC(OC)(C)C)[H])[H])[H] |
| SPLASH |
splash10-0udi-0900100000-cc9b50b18c132db7388a |
| Source of Spectrum |
F-53-8396-0 |
| Synonyms |
(3aS,4R,5aS,6aR,10aR,10bR,10cR)-8-iodo-4-[(1-methoxy-1-methylethoxy)methyl]-2,2,10,10-tetramethyl-3a,5a,6a,7,10,10a,10b,10c-octahydro-4H-[1,3]dioxolo[4',5':4,5]pyrano[2,3-b][1]benzofuran |
| Wiley ID |
802638 |
![4a(S),4b(S),5(R),8a(R),9(R),10a(S)11a(R)-9-Dimethylmethoxymethyl-2-iodo-7,7,4,4-tetramethyl-1,4,4a,4b,5,8a,9,10a,11a-nonahydro-6,8,10,11-tetraoxacyclopenta[a]fluorene](/api/spectrum/A9gtShR7rwv/structure.png?h=300&w=458 "4a(S),4b(S),5(R),8a(R),9(R),10a(S)11a(R)-9-Dimethylmethoxymethyl-2-iodo-7,7,4,4-tetramethyl-1,4,4a,4b,5,8a,9,10a,11a-nonahydro-6,8,10,11-tetraoxacyclopenta[a]fluorene")
